SCHEMBL326755

SCHEMBL326755

COc1cc(C=O)cc(C=O)c1O

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 17/20 0.68
LMNA P02545 1/20 0.57
MAPT P10636 1/20 0.57
TLR2 O60603 1/20 0.55
TLR1 Q15399 1/20 0.55
TLR6 Q9Y2C9 1/20 0.55
TRIM24 O15164 1/20 0.55
ALDH1A1 P00352 1/20 0.55
HPGD P15428 1/20 0.55
ALDH5A1 P51649 1/20 0.55
ABAT P80404 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
TRIM33 Q9UPN9 1/20 0.55

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8679776 1.00 ERN1 (0.68) ERN1LMNAMAPTTLR2TLR1
SCHEMBL30393705 1.00 ERN1 (0.68) ERN1LMNAMAPTTLR2TLR1
SCHEMBL20680483 0.89 ERN1 (0.76) ERN1TLR2TLR1TLR6
SCHEMBL8679779 0.89 ERN1 (0.59) ERN1LMNAMAPTTRIM24ALDH1A1
Syringaldehyde SCHEMBL2110596 0.88 ALDH1A1 (0.62) ERN1LMNAMAPTTRIM24ALDH1A1
Syringaldehyde SCHEMBL150376 0.88 ALDH1A1 (0.62) ERN1LMNAMAPTTRIM24ALDH1A1
Syringaldehyde SCHEMBL30119623 0.88 ALDH1A1 (0.62) ERN1LMNAMAPTTRIM24ALDH1A1
SCHEMBL22917545 0.87 ERN1 (0.62) ERN1LMNAMAPTTLR2TLR1
SCHEMBL4072417 0.87 ERN1 (0.53) ERN1LMNAMAPTTLR2TLR1
Syringaldehyde SCHEMBL28642631 0.86 ALDH1A1 (0.60) ERN1LMNAMAPTTRIM24ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 100 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11484052-B2 Vanillin and/or ethylvanillin, process for their preparations and use thereof RHODIA OPERATIONS (FR) 2022-11-01 US claimed
US-20210120854-A1 NEW VANILLIN AND/OR ETHYLVANILLIN, PROCESS FOR THEIR PREPARATIONS AND USE THEREOF SPECIALTY OPERATIONS FRANCE (FR) 2021-04-29 US claimed
EP-3658525-A1 NEW VANILLIN AND/OR ETHYLVANILLIN, PROCESS FOR THEIR PREPARATIONS AND USE THEREOF Rhodia Operations (FR) 2020-06-03 EP claimed
CN-110944969-A Novel vanillin and/or ethyl vanillin, method for the production thereof and use thereof 罗地亚经营管理公司 2020-03-31 CN claimed
WO-2019020773-A1 NEW VANILLIN AND/OR ETHYLVANILLIN, PROCESS FOR THEIR PREPARATIONS AND USE THEREOF RHODIA OPERATIONS (FR) 2019-01-31 WO claimed
US-20190031588-A1 NEW VANILLIN AND OR ETHYLVANILLIN, PROCESS FOR THEIR PREPARATIONS AND USE THEREOF SPECIALTY OPERATIONS FRANCE (FR) 2019-01-31 US claimed
US-20170172184-A1 Methods of Improving Production of Vanillin EVOLVA SA (CH) 2017-06-22 US claimed
WO-2015121379-A2 METHODS OF IMPROVING PRODUCTION OF VANILLIN EVOLVA SA (CH) 2015-08-20 WO claimed
EP-0946482-B1 METHOD FOR PREPARING A 4-HYDROXYBENZALDEHYDE AND DERIVATIVES RHODIA CHIMIE SA (FR) 2002-07-24 EP claimed
US-6184421-B1 SELECTIVE OXIDATION, TO A CARBOXY GROUP, OF THE GROUP IN THE 2 POSITION WITH RESPECT TO THE HYDROXYL GROUPS OF A MIXTURE OF PHENOLS HAVING FORMYL AND/OR HYDROXYMETHYL GROUPS IN POSITIONS 2 OR 4; PREPARING VANILLIN AND ETHYL VANILLIN RHODIA CHIMIE (FR) 2001-02-06 US claimed
EP-0773919-B1 METHOD FOR PREPARING 3-CARBOXY-4-HYDROXYBENZALDEHYDES AND DERIVATIVES THEREOF RHODIA CHIMIE SA (FR) 2000-09-20 EP claimed
EP-0946482-A1 METHOD FOR PREPARING A 4-HYDROXYBENZALDEHYDE AND DERIVATIVES RHODIA CHIMIE (FR) 1999-10-06 EP claimed
US-5783737-A Process for the preparation of 3-carboxy-4-hydroxybenzaldehides and derivatives thereof RHONE-POULENC CHIMIE (FR) 1998-07-21 US claimed
WO-1998022419-A1 METHOD FOR PREPARING A 4-HYDROXYBENZALDEHYDE AND DERIVATIVES RHODIA CHIMIE (FR) 1998-05-28 WO claimed
EP-0773919-A1 METHOD FOR PREPARING 3-CARBOXY-4-HYDROXYBENZALDEHYDES AND DERIVATIVES THEREOF RHONE-POULENC CHIMIE (FR) 1997-05-21 EP claimed
WO-1996037454-A1 METHOD FOR PREPARING 3-CARBOXY-4-HYDROXYBENZALDEHYDES AND DERIVATIVES THEREOF RHONE-POULENC CHIMIE (FR) 1996-11-28 WO claimed
US-4474994-A EXTRACTION WITH CARBON DIOXIDE MONSANTO COMPANY (US) 1984-10-02 US claimed
EP-0044260-B1 PROCESS FOR THE PREPARATION OF POLYPHENOLS OPTIONALLY SUBSTITUTED BY AN ALDEHYDE GROUP RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1984-04-11 EP claimed
US-4435601-A OXIDATION WITH HYDROGEN PEROXIDE IN ALKALI OR ALKALINE METAL BASE RHONE-POULENC INDUSTRIES (FR) 1984-03-06 US claimed
EP-4423163-B1 BIOBASED AMINE CURING AGENT FOR CURABLE COMPOSITIONS SIKA TECH AG (CH) 2025-06-25 EP disclosed
US-20240360271-A1 BIO-BASED AMINE CURING AGENT FOR CURABLE COMPOSITIONS SIKA TECHNOLOGY AG (CH) 2024-10-31 US disclosed
EP-4423163-A1 BIO-BASED AMINE CURING AGENT FOR CURABLE COMPOSITIONS Sika Technology AG (CH) 2024-09-04 EP disclosed
CN-118019775-A Bio-based amine curing agents for curable compositions SIKA技术股份公司 2024-05-10 CN disclosed
US-11826396-B2 Nutriprotective diet FEDERATION DES PRODUCTEURS ACERICOLES DU QUEBEC (CA) 2023-11-28 US disclosed
WO-2023072786-A1 BIO-BASED AMINE CURING AGENT FOR CURABLE COMPOSITIONS SIKA TECHNOLOGY AG (CH) 2023-05-04 WO disclosed
US-11484052-B2 Vanillin and/or ethylvanillin, process for their preparations and use thereof RHODIA OPERATIONS (FR) 2022-11-01 US disclosed
US-20210120854-A1 NEW VANILLIN AND/OR ETHYLVANILLIN, PROCESS FOR THEIR PREPARATIONS AND USE THEREOF SPECIALTY OPERATIONS FRANCE (FR) 2021-04-29 US disclosed
US-20210120854-A1 NEW VANILLIN AND/OR ETHYLVANILLIN, PROCESS FOR THEIR PREPARATIONS AND USE THEREOF SPECIALTY OPERATIONS FRANCE (FR) 2021-04-29 US disclosed
EP-3658525-A1 NEW VANILLIN AND/OR ETHYLVANILLIN, PROCESS FOR THEIR PREPARATIONS AND USE THEREOF Rhodia Operations (FR) 2020-06-03 EP disclosed
CN-110944969-A Novel vanillin and/or ethyl vanillin, method for the production thereof and use thereof 罗地亚经营管理公司 2020-03-31 CN disclosed
US-20190070245-A1 NUTRIPROTECTIVE DIET FÉDÉRATION DES PRODUCTEURS ACÉRICOLES DU QUÉBEC (CA) 2019-03-07 US disclosed
WO-2019020773-A1 NEW VANILLIN AND/OR ETHYLVANILLIN, PROCESS FOR THEIR PREPARATIONS AND USE THEREOF RHODIA OPERATIONS (FR) 2019-01-31 WO disclosed
WO-2019020773-A1 NEW VANILLIN AND/OR ETHYLVANILLIN, PROCESS FOR THEIR PREPARATIONS AND USE THEREOF RHODIA OPERATIONS (FR) 2019-01-31 WO disclosed
US-20190031588-A1 NEW VANILLIN AND OR ETHYLVANILLIN, PROCESS FOR THEIR PREPARATIONS AND USE THEREOF SPECIALTY OPERATIONS FRANCE (FR) 2019-01-31 US disclosed
US-20190031588-A1 NEW VANILLIN AND OR ETHYLVANILLIN, PROCESS FOR THEIR PREPARATIONS AND USE THEREOF SPECIALTY OPERATIONS FRANCE (FR) 2019-01-31 US disclosed
US-9981901-B2 IRE-1α inhibitors FOSUN ORINOVE PHARMATECH, INC. (CN) 2018-05-29 US disclosed
EP-2754712-B1 MUTANT ENDOGLUCANASE TORAY INDUSTRIES (JP) 2017-10-04 EP disclosed
US-20170172184-A1 Methods of Improving Production of Vanillin EVOLVA SA (CH) 2017-06-22 US disclosed
US-20170152206-A1 IRE-1alpha INHIBITORS FOSUN ORINOVE PHARMATECH, INC. (CN) 2017-06-01 US disclosed
EP-3150589-A1 IRE-1A INHIBITORS MannKind Corporation (US) 2017-04-05 EP disclosed
US-9546149-B2 IRE-1α inhibitors MANNKIND CORPORATION (US) 2017-01-17 US disclosed
US-20160229840-A1 ACTIVATABLE FLUOROGENIC COMPOUNDS AND USES THEREOF AS NEAR INFRARED PROBES RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2016-08-11 US disclosed
CN-103450077-B IRE-1 alpha inhibitor 满康德股份有限公司 2016-07-06 CN disclosed
US-20160168116-A1 IRE-1alpha Inhibitors FOSUN ORINOVE PHARMATECH, INC. (CN) 2016-06-16 US disclosed
US-9341630-B2 Activatable fluorogenic compounds and uses thereof as near infrared probes RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2016-05-17 US disclosed
US-9241942-B2 IRE-1α inhibitors MANNKIND CORPORATION (US) 2016-01-26 US disclosed
CN-105203514-A Reagent and method for fluorescence detection of hypochlorous acid (HClO) UNIV SHANXI 2015-12-30 CN disclosed
US-9193963-B2 Mutant endoglucanase TORAY INDUSTRIES, INC. (JP) 2015-11-24 US disclosed
WO-2015121379-A2 METHODS OF IMPROVING PRODUCTION OF VANILLIN EVOLVA SA (CH) 2015-08-20 WO disclosed
US-20140178947-A1 MUTANT ENDOGLUCANASE NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2014-06-26 US disclosed
US-20140080832-A1 IRE-1alpha INHIBITORS MANNKIND CORPORATION (US) 2014-03-20 US disclosed
US-8614253-B2 IRE-1α inhibitors MANNKIND CORPORATION (US) 2013-12-24 US disclosed
EP-2591023-A2 DEGRADABLE SUPERABSORBENT POLYMERS Reluceo Inc. (US) 2013-05-15 EP disclosed
US-20130065765-A1 DEGRADABLE SUPERABSORBENT POLYMERS RELUCEO, INC. 2013-03-14 US disclosed
EP-2532643-A1 IRE-1A Inhibitors MannKind Corporation (US) 2012-12-12 EP disclosed
EP-2520561-A1 IRE-1A Inhibitors MannKind Corporation (US) 2012-11-07 EP disclosed
WO-2012006278-A2 DEGRADABLE SUPERABSORBENT POLYMERS RELUCEO, INC. (US) 2012-01-12 WO disclosed
CN-102015606-A IRE-1 alpha inhibitors MANNKIND CORP 2011-04-13 CN disclosed
US-7858666-B2 inositol requiring enzyme 1 (IRE-1 alpha) inhibitors such as 2-hydroxy-6-(5-(4-methylpiperazine-1-carbonyl)thiophen-2-yl)-1-naphthaldehyde, relieve protein folding stress by enhancing molecular chaperone activity and protects cells from stress induced apoptosis; autoimmune diseases; anticancer; viricides MANNKIND CORPORATION (US) 2010-12-28 US disclosed
EP-2155643-A1 IRE-1A INHIBITORS MannKind Corporation (US) 2010-02-24 EP disclosed
US-20090186893-A1 IRE-1alpha INHIBITORS MANNKIND CORPORATION (US) 2009-07-23 US disclosed
WO-2008154484-A1 IRE-1A INHIBITORS MANNKIND CORPORATION (US) 2008-12-18 WO disclosed
US-6461423-B1 PHYLLOSILICATES AMCOL INTERNATIONAL CORPORATION 2002-10-08 US disclosed
EP-0946482-B1 METHOD FOR PREPARING A 4-HYDROXYBENZALDEHYDE AND DERIVATIVES RHODIA CHIMIE SA (FR) 2002-07-24 EP disclosed
EP-0780340-B1 Intercalates and exfoliates formed with functional monomeric organic compounds; composite materials containing same and methods of modifying rheology therewith AMCOL INTERNATIONAL CORP (US) 2002-03-20 EP disclosed
US-6184421-B1 SELECTIVE OXIDATION, TO A CARBOXY GROUP, OF THE GROUP IN THE 2 POSITION WITH RESPECT TO THE HYDROXYL GROUPS OF A MIXTURE OF PHENOLS HAVING FORMYL AND/OR HYDROXYMETHYL GROUPS IN POSITIONS 2 OR 4; PREPARING VANILLIN AND ETHYL VANILLIN RHODIA CHIMIE (FR) 2001-02-06 US disclosed
US-6126734-A FORMED BY CONTACTING A LAYERED MATERIAL SUCH AS SODIUM BENTONITE HAVING GIVEN WATER CONTENT, WITH AN INTERCALANT ORGANIC MONOMER COMPRISING C6-24 ALCOHOLS, OR POLYHYDRIC ALCOHOLS; USE AS PLASTICIZERS, THICKENERS AMCOL INTERNATIONAL CORPORATION (US) 2000-10-03 US disclosed
EP-0773919-B1 METHOD FOR PREPARING 3-CARBOXY-4-HYDROXYBENZALDEHYDES AND DERIVATIVES THEREOF RHODIA CHIMIE SA (FR) 2000-09-20 EP disclosed
US-6083559-A CONTACTING PHYLLOSILICATES WITH INTERCALANT AND CARRIER AMCOL INTERNATIONAL CORPORATION (US) 2000-07-04 US disclosed
EP-0946482-A1 METHOD FOR PREPARING A 4-HYDROXYBENZALDEHYDE AND DERIVATIVES RHODIA CHIMIE (FR) 1999-10-06 EP disclosed
US-5830528-A MULTILAYER; CONTAINING PHYLLOSILICATE AMCOL INTERNATIONAL CORPORATION (US) 1998-11-03 US disclosed
US-5783737-A Process for the preparation of 3-carboxy-4-hydroxybenzaldehides and derivatives thereof RHONE-POULENC CHIMIE (FR) 1998-07-21 US disclosed
WO-1998022419-A1 METHOD FOR PREPARING A 4-HYDROXYBENZALDEHYDE AND DERIVATIVES RHODIA CHIMIE (FR) 1998-05-28 WO disclosed
US-5705703-A ENZYME INHIBITORS OF TRANSFERASES HOFFMANN-LA ROCHE INC. (US) 1998-01-06 US disclosed
EP-0780340-A1 Intercalates and exfoliates formed with functional monomeric organic compounds; composite materials containing same and methods of modifying rheology therewith AMCOL INTERNATIONAL CORPORATION (US) 1997-06-25 EP disclosed
US-5633371-A ENZYME INHIBITORS; TREATMENT OF DEPRESSION AND PARKINSON*S DISEASE HOFFMANN-LA ROCHE INC. (US) 1997-05-27 US disclosed
EP-0773919-A1 METHOD FOR PREPARING 3-CARBOXY-4-HYDROXYBENZALDEHYDES AND DERIVATIVES THEREOF RHONE-POULENC CHIMIE (FR) 1997-05-21 EP disclosed
WO-1996037454-A1 METHOD FOR PREPARING 3-CARBOXY-4-HYDROXYBENZALDEHYDES AND DERIVATIVES THEREOF RHONE-POULENC CHIMIE (FR) 1996-11-28 WO disclosed
US-5476875-A Catechol derivatives HOFFMAN-LA ROCHE INC. (US) 1995-12-19 US disclosed
US-5389653-A Inhibitors of the enzyme catechol-O-methyltransferase; useful as co-medication in treatment of Parkinson's disease HOFFMAN-LA ROCHE INC. (US) 1995-02-14 US disclosed
US-5283352-A Transferase inhibitor ORION-YHTYMA OY (FI) 1994-02-01 US disclosed
US-5236952-A Inhibit the enzyme catechol-O-methyltransferase; for treatment of Parkinson's disease administered with L-dopa HOFFMANN-LA ROCHE INC. (US) 1993-08-17 US disclosed
EP-0237929-B1 3,5-DISUBSTITUTED PYROCATECHOL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1993-06-02 EP disclosed
US-5112861-A Inhibitors of catechol-methyl-transferase enzyme, levodopa ORION-YHTYMA OY (FI) 1992-05-12 US disclosed
US-4963590-A ENZYME INHIBITOR FOR TREATING PARKINSON'S DISEASE ALONG WITH DOPA;POTENTIATION ORION-YHTYMA OY (FI) 1990-10-16 US disclosed
US-4847422-A BY-PRODUCTS OF WOOD PULP LIQUOR, OXIDATION, PURIFICATION YHTYNEET PAPERITEHTAAT OY (FI) 1989-07-11 US disclosed
EP-0299620-A1 Thiazolidinedione derivatives BEECHAM GROUP PLC (GB) 1989-01-18 EP disclosed
EP-0237929-A1 3,5-Disubstituted pyrocatechol derivatives F. HOFFMANN-LA ROCHE AG (CH) 1987-09-23 EP disclosed
EP-0091011-B1 PROCESS FOR THE PREPARATION OF PHENYL ETHERS ITT INDUSTRIES, INC. (US) 1987-08-05 EP disclosed
EP-0100451-B1 PROCESS FOR THE HYDROXYLATION OF AROMATIC COMPOUNDS ITT INDUSTRIES, INC. (US) 1986-11-05 EP disclosed
US-4551305-A SULFITE LIQUOR, SUGAR, BASE, ALDEHYDE, ACETIC ACID INTERNATIONAL TELEPHONE AND TELEGRAPH CORPORATION (US) 1985-11-05 US disclosed
US-4474994-A EXTRACTION WITH CARBON DIOXIDE MONSANTO COMPANY (US) 1984-10-02 US disclosed
US-4465864-A Process of hydroxylation of an aromatic carbonyl compound INTERNATIONAL TELEPHONE AND TELEGRAPH CORPORATION (US) 1984-08-14 US disclosed
US-4453004-A Process for the alkylation of phenolic compounds INTERNATIONAL TELEPHONE AND TELEGRAPH CORPORATION (US) 1984-06-05 US disclosed
US-4453017-A ETHERS FROM PHENOLIC ALDEHYDES, ACIDS, OR AMIDES INTERNATIONAL TELEPHONE AND TELEGRAPH CORPORATION (US) 1984-06-05 US disclosed
US-4453018-A ONE-STEP PREPARATION OF ALKYLATED PHENOLIC ETHERS INTERNATIONAL TELEPHONE AND TELEGRAPH CORPORATION (US) 1984-06-05 US disclosed
US-4435601-A OXIDATION WITH HYDROGEN PEROXIDE IN ALKALI OR ALKALINE METAL BASE RHONE-POULENC INDUSTRIES (FR) 1984-03-06 US disclosed
EP-0100451-A1 Process for the hydroxylation of aromatic compounds ITT INDUSTRIES, INC. (US) 1984-02-15 EP disclosed
EP-0091011-A2 Process for the preparation of phenyl ethers ITT INDUSTRIES, INC. (US) 1983-10-12 EP disclosed
US-4165341-A FROM CATECHOL OR A 2-ALKOXYPHENOL AND GLYCOLIC ACID USING ALUMINA OR SILICA CATALYST, OXIDATION UBE INDUSTRIES, LTD. (JP) 1979-08-21 US disclosed
US-4165341-A FROM CATECHOL OR A 2-ALKOXYPHENOL AND GLYCOLIC ACID USING ALUMINA OR SILICA CATALYST, OXIDATION UBE INDUSTRIES, LTD. (JP) 1979-08-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11826396-B2 Nutriprotective diet NEFM, NNMT, SORD ERN1 4711/4885LMNA 2732/4885MAPT 126/4885
US-20210120854-A1 NEW VANILLIN AND/OR ETHYLVANILLIN, PROCESS FOR THEIR PREPARATIONS AND USE THEREOF COMT, VARS1, BPGM ERN1 1351/4885LMNA 2337/4885MAPT 2368/4885
US-20170152206-A1 IRE-1alpha INHIBITORS XBP1, DDIT3, ERN1 ERN1 3/4885LMNA 1886/4885MAPT 3095/4885
US-20160229840-A1 ACTIVATABLE FLUOROGENIC COMPOUNDS AND USES THEREOF AS NEAR INFRARED PROBES PAICS, NQO1, APEX1 ERN1 2602/4885LMNA 931/4885MAPT 3924/4885
US-20160168116-A1 IRE-1alpha Inhibitors XBP1, DDIT3, ERN1 ERN1 3/4885LMNA 1886/4885MAPT 3095/4885
US-20140080832-A1 IRE-1alpha INHIBITORS XBP1, DDIT3, ERN1 ERN1 3/4885LMNA 1886/4885MAPT 3095/4885
US-20190070245-A1 NUTRIPROTECTIVE DIET NEFM, NNMT, SORD ERN1 4711/4885LMNA 2732/4885MAPT 126/4885
US-20090186893-A1 IRE-1alpha INHIBITORS XBP1, DDIT3, ERN1 ERN1 3/4885LMNA 1886/4885MAPT 3095/4885
US-11484052-B2 Vanillin and/or ethylvanillin, process for their preparations and use thereof COMT, VARS1, BPGM ERN1 1109/4885LMNA 2417/4885MAPT 2360/4885
US-20190031588-A1 NEW VANILLIN AND OR ETHYLVANILLIN, PROCESS FOR THEIR PREPARATIONS AND USE THEREOF VARS1, COMT, BPGM ERN1 1093/4885LMNA 2530/4885MAPT 2613/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.