Alcohol

Alcohol

SCHEMBL462789

C=CCCO.CCO

nearest known ligand 0.00

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL11589496 0.89 TSHR (0.50)
SCHEMBL1836 0.89
Propene SCHEMBL28139856 0.87
Alcohol SCHEMBL3470536 0.87 TSHR (0.50)
SCHEMBL4362828 0.86
Hydrogen Sulfide SCHEMBL28750221 0.86
SCHEMBL30578387 0.86
Hydrochloric Acid SCHEMBL3741978 0.86
SCHEMBL31506325 0.86
Ammonia Solution, Strong SCHEMBL679855 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9045592-B2 Process for the preparation of polyether carbonate polyols BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-06-02 US claimed
EP-2614102-B1 METHOD FOR PRODUCING POLYETHER CARBONATE POLYOLS BAYER IP GMBH (DE) 2014-07-23 EP claimed
US-20130184432-A1 PROCESS FOR THE PREPARATION OF POLYETHER CARBONATE POLYOLS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-07-18 US claimed
EP-2614102-A1 METHOD FOR PRODUCING POLYETHER CARBONATE POLYOLS Bayer Intellectual Property GmbH (DE) 2013-07-17 EP claimed
WO-2012032028-A1 METHOD FOR PRODUCING POLYETHER CARBONATE POLYOLS BAYER MATERIALSCIENCE AG (DE) 2012-03-15 WO claimed
CN-108779153-A METHANOL DEHYDROGENASE FUSION PROTEINS 基因组股份公司 2018-11-09 CN disclosed
CN-106211783-A Alcohol dehydrogenase variants 基因组股份公司 2016-12-07 CN disclosed