Alcohol

Alcohol

SCHEMBL3319612

CCO.Cc1ccccc1CO.O

nearest known ligand 0.46

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 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.46
PDCD1 Q15116 1/20 0.45
CD274 Q9NZQ7 1/20 0.45
CYP4F2 P78329 2/20 0.43
CYP4A11 Q02928 2/20 0.43
APOBEC3G Q9HC16 1/20 0.43
KMT2A Q03164 1/20 0.42
TSHR P16473 1/20 0.41
ACHE P22303 1/20 0.41
HPGD P15428 2/20 0.40
ALDH1A1 P00352 1/20 0.40
CTBP2 P56545 1/20 0.40
CHRM2 P08172 1/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
MAPT P10636 1/20 0.39
SHBG P04278 1/20 0.39
KDM4E B2RXH2 1/20 0.37
CYP2A13 Q16696 1/20 0.37

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
Water SCHEMBL809420 0.95 TAAR1 (0.50) TAAR1PDCD1CD274CYP4F2CYP4A11
Ammonia Solution, Strong SCHEMBL7943190 0.93 TAAR1 (0.48) TAAR1PDCD1CD274CYP4F2CYP4A11
Methane SCHEMBL17220519 0.93 TAAR1 (0.48) TAAR1PDCD1CD274CYP4F2CYP4A11
SCHEMBL29928074 0.93
SCHEMBL3338 0.93
Ammonia Solution, Strong SCHEMBL9578178 0.90 TAAR1 (0.50) TAAR1PDCD1CD274CYP4F2CYP4A11
O-Xylene SCHEMBL6552476 0.90 TSHR (0.53) TAAR1PDCD1CD274CYP4F2CYP4A11
Bromide SCHEMBL27700459 0.90 TAAR1 (0.50) TAAR1PDCD1CD274CYP4F2CYP4A11
Hexane SCHEMBL27635320 0.89 LIPG (0.44) TAAR1PDCD1CD274CYP4F2CYP4A11
Hexane SCHEMBL3728497 0.86 LIPG (0.46) TAAR1PDCD1CD274CYP4F2CYP4A11

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
EP-2114941-B1 BICYCLIC HETEROCYCLIC COMPOUNDS AS FGFR INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2015-03-25 EP disclosed
US-8895745-B2 Bicyclic heterocyclic compounds as FGFR inhibitors ASTEX THERAPEUTICS LIMITED (GB) 2014-11-25 US disclosed
US-20100120761-A1 Bicyclic Heterocyclic Compounds as FGFR Inhibitors ASTEX THERAPEUTICS LIMITED (GB) 2010-05-13 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-20100120761-A1 Bicyclic Heterocyclic Compounds as FGFR Inhibitors FGFR3, FGFR1, FGFR2 TAAR1 4572/4885PDCD1 319/4885CD274 273/4885

“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.