Alcohol

Alcohol

SCHEMBL718819

CC(C)(C)COCC(C)(C)C.CCO

nearest known ligand 0.40

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 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
ALDH1A1 P00352 2/20 0.40
TDP1 Q9NUW8 1/20 0.35
CYP2C19 P33261 1/20 0.35
GBA2 Q9HCG7 2/20 0.31

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
Ethylene Glycol SCHEMBL6377525 0.87 CYP2C19 (0.35) TSHRALDH1A1CYP2C19GBA2
Methyl Alcohol SCHEMBL4271767 0.86 CYP2C19 (0.38) TSHRTDP1CYP2C19
SCHEMBL18191 0.86 CYP2C19 (0.42) TSHRTDP1CYP2C19
Methyl Alcohol SCHEMBL20601076 0.83 CYP2C19 (0.36) CYP2C19
Ammonia Solution, Strong SCHEMBL27688316 0.82 CYP2C19 (0.40) TSHRTDP1CYP2C19
Hydrochloric Acid SCHEMBL8858515 0.82 CYP2C19 (0.40) TSHRTDP1CYP2C19
SCHEMBL28557000 0.82 CYP2C19 (0.40) TSHRTDP1CYP2C19
Ether SCHEMBL1414943 0.80 TSHR (0.35) TSHRALDH1A1TDP1CYP2C19
SCHEMBL1530161 0.80
SCHEMBL6032267 0.79 NUDT1 (0.32) TSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12037324-B2 Biarylmethyl heterocycles BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-16 US disclosed
EP-3478672-B1 BIARYLMETHYL HETEROCYCLES UNIV MONTREAL (CA) 2024-04-10 EP disclosed
US-20230045357-A1 BIARYLMETHYL HETEROCYCLES Université de Montréal (CA) 2023-02-09 US disclosed
US-20190202808-A1 BIARYLMETHYL HETEROCYCLES BRISTOL-MYERS SQUIBB COMPANY 2019-07-04 US disclosed
EP-2464634-B1 REGIOSELECTIVE PREPARATION OF 2-AMINO-5-TRIFLUOROMETHYLPYRIMIDINE DERIVATIVES BOEHRINGER INGELHEIM INT (DE) 2016-11-30 EP disclosed
US-9040564-B2 Stabilized composition EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-05-26 US disclosed
US-8933227-B2 Selective synthesis of functionalized pyrimidines BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-01-13 US disclosed
EP-2464634-A1 REGIOSELECTIVE PREPARATION OF 2 -AMINO-5-TRIFLUOROMETHYLPYRIMIDINE DERIVATIVES Boehringer Ingelheim International GmbH (DE) 2012-06-20 EP disclosed
US-8124780-B2 Benzimidazole compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-02-28 US disclosed
US-20110190499-A1 SELECTIVE SYNTHESIS OF FUNCTIONALIZED PYRIMIDINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-08-04 US disclosed
WO-2005095379-A2 CRYSTALLINE METHANESULFONIC ACID ADDITION SALTS OF IMATINIB INSTYTUT FARMACEUTYCZNY (PL) 2005-10-13 WO disclosed
US-6906083-B2 4-substituted piperidine compound EISAI CO., LTD. (JP) 2005-06-14 US disclosed
US-20050026895-A1 4-Substituted piperidine compound EISAI CO., LTD. 2005-02-03 US disclosed
US-20030166925-A1 4-Substituted piperidine compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2003-09-04 US disclosed
EP-1308781-A2 Cyclic sulfonium and sulfoxonium photoacid generators and photoresists containing them Shipley Co. L.L.C. (US) 2003-05-07 EP disclosed
EP-1300395-A1 4-SUBSTITUTED PIPERIDINE COMPOUND Eisai Co., Ltd. (JP) 2003-04-09 EP disclosed
US-5624922-A Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1997-04-29 US disclosed
EP-0597540-B1 Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC (US) 1996-06-05 EP disclosed
US-5380721-A Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1995-01-10 US disclosed
EP-0597540-A1 Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1994-05-18 EP 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 (6 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-20110190499-A1 SELECTIVE SYNTHESIS OF FUNCTIONALIZED PYRIMIDINES DPYD, TYMS, UMPS TSHR 2996/4885ALDH1A1 727/4885TDP1 623/4885
US-20190202808-A1 BIARYLMETHYL HETEROCYCLES ARRB1, ADRB2, ADRB1 TSHR 429/4885ALDH1A1 919/4885TDP1 4458/4885
US-20050026895-A1 4-Substituted piperidine compound ACHE, CHRM2, CHRM1 TSHR 1527/4885ALDH1A1 80/4885TDP1 2020/4885
US-20030166925-A1 4-Substituted piperidine compound ACHE, CHRM4, CHRM1 TSHR 2161/4885ALDH1A1 66/4885TDP1 1433/4885
US-12037324-B2 Biarylmethyl heterocycles ARRB1, ADRB2, ADRB1 TSHR 429/4885ALDH1A1 919/4885TDP1 4458/4885
US-20230045357-A1 BIARYLMETHYL HETEROCYCLES ARRB1, ADRB2, ADRB1 TSHR 429/4885ALDH1A1 919/4885TDP1 4458/4885

“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.