Alcohol

Alcohol

SCHEMBL5149703

CCC(CC)(C(=O)O)C(=O)O.CCO.CCO.CCO.[Ti]

nearest known ligand 0.37

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 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
TSHR P16473 3/20 0.35
FFAR3 O14843 2/20 0.35
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
THRB P10828 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
GRM2 Q14416 1/20 0.30
GRM3 Q14832 1/20 0.30

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
Methyl Alcohol SCHEMBL5149498 0.91 FFAR3 (0.37) ALDH1A1TSHRFFAR3MEN1CYP1A2
SCHEMBL51201 0.91 FFAR3 (0.41) ALDH1A1TSHRFFAR3MEN1CYP1A2
Ethylene Glycol SCHEMBL5469827 0.88 FFAR3 (0.35) ALDH1A1TSHRFFAR3MEN1CYP1A2
Hydrochloric Acid SCHEMBL8053454 0.88 FFAR3 (0.39) ALDH1A1TSHRFFAR3MEN1CYP1A2
SCHEMBL9489101 0.88 FFAR3 (0.39) ALDH1A1TSHRFFAR3MEN1CYP1A2
SCHEMBL4382923 0.88 FFAR3 (0.39) ALDH1A1TSHRFFAR3MEN1CYP1A2
SCHEMBL17818653 0.88 FFAR3 (0.39) ALDH1A1TSHRFFAR3MEN1CYP1A2
SCHEMBL28746064 0.88 FFAR3 (0.39) ALDH1A1TSHRFFAR3MEN1CYP1A2
SCHEMBL3673385 0.88 ALDH1A1 (0.39) ALDH1A1TSHRFFAR3MEN1CYP1A2
SCHEMBL104624 0.88 FFAR3 (0.39) ALDH1A1TSHRFFAR3MEN1CYP1A2

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-1749859-B1 CURABLE COMPOSITION KANEKA CORP (JP) 2019-09-11 EP disclosed
US-20070287780-A1 Curable Composition KANEKA CORPORATION (JP) 2007-12-13 US disclosed
EP-1749859-A1 CURABLE COMPOSITION Kaneka Corporation (JP) 2007-02-07 EP disclosed