Alcohol

Alcohol

SCHEMBL7528524

CCO.OCCc1cccc(Br)c1

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Alcohol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.57
TDP1 Q9NUW8 1/20 0.46
CYP4F2 P78329 2/20 0.46
CYP4A11 Q02928 2/20 0.46
IDO1 P14902 2/20 0.46
AGXT P21549 2/20 0.46
CYP1A2 P05177 2/20 0.44
CYP2D6 P10635 2/20 0.44
CYP2C19 P33261 2/20 0.44
MAOB P27338 1/20 0.43
RIPK1 Q13546 1/20 0.43

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
SCHEMBL643177 0.94 TAAR1 (0.63) TAAR1TDP1CYP4F2CYP4A11IDO1
SCHEMBL81535 0.82 TAAR1 (0.59) TAAR1CYP4F2CYP4A11IDO1AGXT
SCHEMBL29979925 0.81 TAAR1 (0.63) TAAR1TDP1IDO1AGXTCYP1A2
SCHEMBL1513555 0.81 TAAR1 (0.63) TAAR1TDP1IDO1AGXTCYP1A2
SCHEMBL4399626 0.80 TAAR1 (0.74) TAAR1TDP1IDO1AGXTMAOB
SCHEMBL1047547 0.80 TAAR1 (0.57) TAAR1CYP4F2CYP4A11IDO1AGXT
Ammonia Solution, Strong SCHEMBL1766782 0.79 TAAR1 (0.61) TAAR1TDP1IDO1AGXTCYP1A2
SCHEMBL1045131 0.78 TAAR1 (0.55) TAAR1CYP4F2CYP4A11IDO1AGXT
SCHEMBL3456345 0.78 TAAR1 (0.55) TAAR1CYP4F2CYP4A11IDO1AGXT
Alcohol SCHEMBL6297380 0.78 TAAR1 (0.46) TAAR1IDO1AGXTCYP1A2CYP2D6

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020188018-A1 3-indolyl-4-phenyl-1H-pyrrole-2,5-dione derivatives as inhibitors of glycogen synthase kinase-3beta GONG LEYI (US) 2002-12-12 US disclosed
US-6479490-B2 TREATMENT OF DISEASES CHARACTERIZED BY EXCESS TH2 CYTOKINES AND/ OR AN EXCESS IGE PRODUCTION. SYNTEX (U.S.A.) LLC 2002-11-12 US disclosed
US-20020052397-A1 3-indolyl-4-phenyl-1H-pyrrole-2,5-dione derivatives as inhibitors of glycogen synthase kinase-3beta SYNTEX (U.S.A.) LLC 2002-05-02 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 (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-20020052397-A1 3-indolyl-4-phenyl-1H-pyrrole-2,5-dione derivatives as inhibitors of glycogen synthase kinase-3beta GSK3B, GSK3A, PYGL TAAR1 4735/4885TDP1 1121/4885CYP4F2 2611/4885
US-20020188018-A1 3-indolyl-4-phenyl-1H-pyrrole-2,5-dione derivatives as inhibitors of glycogen synthase kinase-3beta GSK3B, GSK3A, PYGL TAAR1 4612/4885TDP1 1395/4885CYP4F2 2714/4885

“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.