SCHEMBL74689

SCHEMBL74689

COc1cc(Br)ccc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.61
APP P05067 2/20 0.58
SLC22A6 Q4U2R8 1/20 0.53
SLC22A8 Q8TCC7 1/20 0.53
MEN1 O00255 1/20 0.53
RAB9A P51151 1/20 0.53
KMT2A Q03164 1/20 0.53
ALDH1A1 P00352 2/20 0.52
HPGD P15428 2/20 0.52
TRPA1 O75762 1/20 0.52
TRIM24 O15164 1/20 0.52
ALDH5A1 P51649 1/20 0.52
ABAT P80404 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
TRIM33 Q9UPN9 1/20 0.52
HTT P42858 1/20 0.52
ALOX15 P16050 2/20 0.52
ALOX12 P18054 1/20 0.52
CXCL12 P48061 1/20 0.51
CA2 P00918 2/20 0.50

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
SCHEMBL29744489 1.00 MAOB (0.61) MAOBAPPSLC22A6SLC22A8MEN1
SCHEMBL27542420 0.98 MAOB (0.59) MAOBAPPSLC22A6SLC22A8MEN1
Formaldehyde SCHEMBL27423139 0.94 MAOB (0.55) MAOBAPPSLC22A6SLC22A8MEN1
SCHEMBL27983169 0.86 HSD17B2 (0.50) MAOBAPPSLC22A6SLC22A8MEN1
Propionaldehyde SCHEMBL27983170 0.86 ALDH1A1 (0.53) MAOBAPPSLC22A6SLC22A8MEN1
SCHEMBL4808985 0.84 MAOB (0.53) MAOBAPPSLC22A6SLC22A8MEN1
SCHEMBL41497 0.82 ALDH1A1 (0.52) APPMEN1KMT2AALDH1A1TDP1
SCHEMBL30152196 0.82 ALDH1A1 (0.52) APPMEN1KMT2AALDH1A1TDP1
SCHEMBL30688242 0.81 ALOX15 (0.66) APPMEN1KMT2AALDH1A1HPGD
SCHEMBL347489 0.81 ALOX15 (0.66) APPMEN1KMT2AALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114516784-B Novel vanillin synthesis process 万华化学集团股份有限公司 2023-05-30 CN claimed
CN-114516784-A Novel vanillin synthesis process 万华化学集团股份有限公司 2022-05-20 CN claimed
CN-113278045-A Polypeptide C (sp) guided by natural amino acid3) Method for arylation or alkynylation modification of-H bond 浙江工业大学 2021-08-20 CN claimed
CN-106316853-A Compound for liquid crystal alignment layer and making method and application thereof, composite comprising said compound DIC株式会社 2017-01-11 CN claimed
EP-2574192-B1 PROCESS FOR PREPARING AN ORTHO-SUBSTITUTED 5-HALOPHENOL AND A SYNTHESIS INTERMEDIATE THEREOF RHODIA CHINA CO LTD (CN) 2016-09-21 EP claimed
CN-103864585-B One prepares the method for 3,4,5-trimethoxytoluene UNIVERSITY OF SCIENCE AND TECHNOLOGY OF CHINA (CN) 2015-11-25 CN claimed
CN-104693014-A Synthesis method of 5-bromo-2-methoxyphenol JUYE JINYUAN PHARMACEUTICAL TECHNOLOGY CO LTD 2015-06-10 CN claimed
US-8975431-B2 Process for preparing an ortho-substituted 5-halophenol and a synthesis intermediate thereof RHODIA OPERATIONS (FR) 2015-03-10 US claimed
CN-103864585-A Method for preparing 3,4,5-triethoxy methylbenzene USTC UNIV SCIENCE TECH CN 2014-06-18 CN claimed
CN-103553889-A Synthetic method of paradol SUZHOU UUGENE BIOPHARMA CO LTD 2014-02-05 CN claimed
WO-2011143819-A1 PROCESS FOR PREPARING AN ORTHO-SUBSTITUTED 5-HALOPHENOL AND A SYNTHESIS INTERMEDIATE THEREOF RHODIA (CHINA) CO., LTD. (CN) 2011-11-24 WO claimed
CN-101146786-A Piperazinyl and piperidinyl ureas as modulators of fatty acid amide hydrolase JANSSEN PHARMACEUTICA NV (BE) 2008-03-19 CN claimed
US-20050043369-A1 Bactericidal antimicrobial methods and compositions for use in treating gram positive infections PROTEZ PHARMACEUTICALS INC. (US) 2005-02-24 US claimed
WO-2004065411-A2 PEPTIDES THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2004-08-05 WO claimed
US-20030225126-A1 Bactericidal antimicrobial methods and compositions for use in treating gram positive infections INFLUX, INC. 2003-12-04 US claimed
EP-1296688-A2 BACTERICIDAL ANTIMICROBIAL METHODS AND COMPOSITIONS FOR USE IN TREATING GRAM POSITIVE INFECTIONS COMPRISING AN ANTIBIOTIC POTENTIATOR HAVING ACYL HYDRAZIDE, OXY AMIDE OR 8-HYDROXY QUINOLINE STRUCTURE Influx, Inc. (US) 2003-04-02 EP claimed
WO-2001070213-A2 BACTERICIDAL ANTIMICROBIAL METHODS AND COMPOSITIONS FOR USE IN TREATING GRAM POSITIVE INFECTIONS COMPRISING AN ANTIBIOTIC POTENTIATOR HAVING ACYL HYDRAZIDE OXY AMIDE OR 8-HYDROXY QUINOLINE STRUCTURE INFLUX, INC. (US) 2001-09-27 WO claimed
EP-0331593-B1 PROCESS FOR THE PREPARATION OF HYDROXYBENZALDEHYDES BY HYDROCARBONYLATION RHONE-POULENC CHIMIE (FR) 1992-11-25 EP claimed
EP-0351336-B1 PROCESS FOR THE PREPARATION OF HYDROXYBENZALDEHYDES BY HYDROCARBONYLATION RHONE-POULENC CHIMIE (FR) 1992-10-28 EP claimed
US-4933497-A Preparation of hydroxybenzaldehydes by hydrocarbonylation of halophenols RHONE-POULENC CHIMIE (FR) 1990-06-12 US claimed

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

For each of this compound's patents that has machine-readable text (2 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-20030225126-A1 Bactericidal antimicrobial methods and compositions for use in treating gram positive infections NAAA, TLR8, OPA1 MAOB 630/4885APP 4245/4885SLC22A6 3644/4885
US-20050043369-A1 Bactericidal antimicrobial methods and compositions for use in treating gram positive infections NAAA, TLR8, OPA1 MAOB 630/4885APP 4245/4885SLC22A6 3644/4885

“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.