Alcohol

Alcohol

SCHEMBL2695339

C=CCC.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
Ethylene Glycol SCHEMBL720973 0.88
Methyl Alcohol SCHEMBL998584 0.87
SCHEMBL4950820 0.87 TSHR (0.50)
SCHEMBL3814841 0.87
SCHEMBL2430668 0.87 TSHR (0.50)
SCHEMBL10862 0.87
SCHEMBL5606390 0.87
SCHEMBL4901795 0.87 TSHR (0.50)
SCHEMBL9245377 0.83
Allyl Alcohol SCHEMBL2287551 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103254196-B Preparation method of pemetrexed diacid SUZHOU MIRACPHARMA TECHNOLOGY CO LTD 2015-02-18 CN disclosed
US-8884062-B2 Aminodihydrothiazine derivatives substituted with a cyclic group SHIONOGI & CO., LTD. (JP) 2014-11-11 US disclosed
EP-2147914-B1 AMINODIHYDROTHIAZINE DERIVATIVES SUBSTITUTED WITH CYCLIC GROUPS SHIONOGI & CO (JP) 2014-06-04 EP disclosed
US-20140073815-A1 AMINODIHYDROTHIAZINE DERIVATIVES SUBSTITUTED WITH A CYCLIC GROUP SHIONOGI & CO., LTD. (JP) 2014-03-13 US disclosed
EP-2689780-A1 Intermediates for aminodihydrothiazine derivatives substituted with a cyclic group SHIONOGI & CO., LTD. (JP) 2014-01-29 EP disclosed
US-8541408-B2 Aminodihydrothiazine derivatives substituted with a cyclic group SHIONOGI & CO., LTD. (JP) 2013-09-24 US disclosed
CN-103254196-A Preparation method of pemetrexed diacid SUZHOU MINGRUI MEDICAL TECHNOLOGY CO LTD 2013-08-21 CN disclosed
US-8507479-B2 2013-08-13 US disclosed
US-20120172355-A1 AMINODIHYDROTHIAZINE DERIVATIVES SUBSTITUTED WITH A CYCLIC GROUP SHIONOGI & CO., LTD. (JP) 2012-07-05 US disclosed
US-8168630-B2 Aminodihydrothiazine derivatives substituted with a cyclic group SHIONOGI & CO., LTD. (JP) 2012-05-01 US disclosed
US-20100075957-A1 AMINODIHYDROTHIAZINE DERIVATIVES SUBSTITUTED WITH A CYCLIC GROUP SHIONOGI & CO., LTD. (JP) 2010-03-25 US disclosed
EP-2147914-A1 AMINODIHYDROTHIAZINE DERIVATIVES SUBSTITUTED WITH CYCLIC GROUPS Shionogi&Co., Ltd. (JP) 2010-01-27 EP disclosed
CN-100408439-C Device for dispensing selected material to liquid and its mfg. method BIOGAIA BIOLOG AB (SE) 2008-08-06 CN disclosed
CN-1618705-A Device for dispensing selected material to liquid and its mfg. method BIOGAIA BIOLOG AB (SE) 2005-05-25 CN disclosed
CN-1187012-C Device for dispensing viable cells of a native microorganism into a liquid and method for producing the same BIOGAIA BIOLOG AB (SE) 2005-02-02 CN disclosed
CN-1374917-A Distributing pipe BIOGAIA BIOLOG AB (SE) 2002-10-16 CN disclosed