Alcohol

Alcohol

SCHEMBL365568

CC(C)[C@H]1CC[C@@H](C)C/C=C/[C@@H](C)CC1.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
SCHEMBL107278 0.91
SCHEMBL107277 0.91
SCHEMBL113143 0.91
SCHEMBL17913059 0.81
SCHEMBL17913067 0.81
SCHEMBL17913057 0.81
SCHEMBL17913075 0.78
SCHEMBL17913063 0.78
SCHEMBL17913061 0.78
SCHEMBL17913058 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1916307-B1 Plant enzymes for bioconversion DAFRA PHARMA RES & DEV BVBA (BE) 2014-02-26 EP disclosed
US-8163980-B2 Polynucleotides encoding isoprenoid modifying enzymes and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-04-24 US disclosed
US-8097438-B2 Nucleic acids encoding modified cytochrome P450 enzymes and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-01-17 US disclosed
US-20110008829-A1 Use of Synthetic Scaffolds for the Production of Biosynthetic Pathway Products THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2011-01-13 US disclosed
US-20080124772-A1 Plant enzymes for bioconversion PLANT RESEARCH INTERNATIONAL B.V. 2008-05-29 US disclosed
EP-1916307-A1 Plant enzymes for bioconversion Plant Research International B.V. (NL) 2008-04-30 EP disclosed
US-20070300327-A1 Plant enzymes for bioconversion PLANT RESEARCH INTERNATIONAL B.V. 2007-12-27 US disclosed
US-7214507-B2 Plant enzymes for bioconversion PLANT RESEARCH INTERNATIONAL B.V. (NL) 2007-05-08 US disclosed
US-20050019882-A1 Using plant enzymes for the production of flavor, fragrance, pharmaceutical or bio-control agents from less valuable substrates; terpenoid biosynthesis STICHTING DIENST LANDBOUWKUNDIG ONDERZOEK (NL) 2005-01-27 US disclosed
EP-1427838-A1 PLANT ENZYMES FOR BIOCONVERSION Plant Research International B.V. (NL) 2004-06-16 EP disclosed
WO-2003025193-A1 PLANT ENZYMES FOR BIOCONVERSION PLANT RESEARCH INTERNATIONAL B.V. (NL) 2003-03-27 WO disclosed