SCHEMBL829369

SCHEMBL829369

COc1cc(CO)cc(CO)c1O

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.52
CASP6 P55212 1/20 0.52
MAPT P10636 2/20 0.50
TNKS2 Q9H2K2 1/20 0.49
PDE4A P27815 1/20 0.48
PDE4B Q07343 1/20 0.48
PDE4C Q08493 1/20 0.48
PDE4D Q08499 1/20 0.48
SHBG P04278 1/20 0.46
TRPV1 Q8NER1 1/20 0.44
ALOX5 P09917 5/20 0.43
AKR1B1 P15121 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
ERN1 O75460 1/20 0.43
LMNA P02545 1/20 0.42
GAA P10253 2/20 0.42
PTGS2 P35354 3/20 0.41

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
SCHEMBL930805 0.90 TNKS2 (0.56) TNKS2PDE4APDE4BPDE4CPDE4D
SCHEMBL211114 0.90 SHBG (0.58) TNKS2PDE4APDE4BPDE4CPDE4D
SCHEMBL15698190 0.89 TNKS2 (0.60) KDM4ECASP6MAPTTNKS2PDE4A
SCHEMBL10130847 0.89 PTGS2 (0.52) KDM4ECASP6MAPTTNKS2PDE4A
SCHEMBL14606346 0.89 SHBG (0.56) KDM4EMAPTTNKS2PDE4APDE4B
SCHEMBL10130966 0.89 TRPV1 (0.52) KDM4ECASP6MAPTTNKS2PDE4A
SCHEMBL1067240 0.87 TNKS2 (0.55) KDM4EMAPTTNKS2PDE4APDE4B
Guaiacol SCHEMBL11051755 0.87 TSHR (0.55) KDM4ECASP6MAPTTNKS2ALOX5
SCHEMBL15221748 0.85 TNKS2 (0.51) TNKS2PDE4APDE4BPDE4CPDE4D
SCHEMBL10130851 0.85 SHBG (0.56) KDM4EMAPTTNKS2PDE4APDE4B

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 65 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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-2321247-B1 METHOD FOR SEPARATING AROMATIC ALDEHYDE RHODIA OPERATIONS (FR) 2016-02-17 EP disclosed
US-20150344507-A1 PHOSPHORUS-CONTAINING COMPOUNDS USEFUL FOR MAKING HALOGEN-FREE, IGNITION-RESISTANT POLYMERS BLUE CUBE IP LLC (US) 2015-12-03 US disclosed
US-20150126690-A1 PHOSPHORUS-CONTAINING COMPOUNDS USEFUL FOR MAKING HALOGEN-FREE, IGNITION-RESISTANT POLYMERS BLUE CUBE IP LLC 2015-05-07 US disclosed
US-9018421-B2 Separation of aromatic aldehydes RHODIA OPERATIONS (FR) 2015-04-28 US disclosed
US-8962773-B2 Phosphorus-containing compounds useful for making halogen-free, ignition-resistant polymers DOW GLOBAL TECHNOLOGIES LLC (US) 2015-02-24 US disclosed
EP-0485613-A1 PROCESS FOR PARA-METHYLOLATING PHENOLIC COMPOUND MITSUBISHI CHEMICAL CORPORATION (JP) 1992-05-20 EP disclosed
US-5019656-A Hydroxymethylation of a Phenol, Basic Catalyst, Crown Compound MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1991-05-28 US disclosed
EP-0386639-A1 Process for preparing para-hydroxybenzyl alcohol MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1990-09-12 EP disclosed
US-4435601-A OXIDATION WITH HYDROGEN PEROXIDE IN ALKALI OR ALKALINE METAL BASE RHONE-POULENC INDUSTRIES (FR) 1984-03-06 US disclosed
US-4119671-A OXIDATION OF HYDROXYBENZYL ALCOHOLS, PLATINUM CATALYST, ACTIVATORS BAYER AKTIENGESELLSCHAFT (DE) 1978-10-10 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 (1 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-20150344507-A1 PHOSPHORUS-CONTAINING COMPOUNDS USEFUL FOR MAKING HALOGEN-FREE, IGNITION-RESISTANT POLYMERS PFAS, EBNA1BP2, PIP5K1A KDM4E 1179/4885CASP6 4062/4885MAPT 3337/4885

“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.