Alcohol

Alcohol

SCHEMBL7806293

CCCCCCCCCCCCCCCCCC(=O)OC(COC)COCC(O)CO.CCO

nearest known ligand 0.68

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 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.60
MAPK1 P28482 1/20 0.60
LMNA P02545 2/20 0.60
KDM4E B2RXH2 1/20 0.60
DUSP3 P51452 1/20 0.60
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
ALDH1A1 P00352 1/20 0.57
PRKCA P17252 3/20 0.57
PRKCE Q02156 2/20 0.57
PRKCQ Q04759 2/20 0.57
PRKCD Q05655 2/20 0.57
LPAR6 P43657 1/20 0.56
LPAR1 Q92633 1/20 0.56
LPAR4 Q99677 1/20 0.56
LPAR5 Q9H1C0 1/20 0.56
LPAR2 Q9HBW0 1/20 0.56
LPAR3 Q9UBY5 1/20 0.56
USP2 O75604 1/20 0.54
DGKA P23743 1/20 0.52

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
SCHEMBL20202521 0.94 MAPT (0.68) MAPTMAPK1LMNAKDM4EDUSP3
SCHEMBL28225640 0.90 MAPT (0.71) MAPTMAPK1LMNAKDM4EDUSP3
SCHEMBL3453977 0.90 MAPT (0.71) MAPTMAPK1LMNAKDM4EDUSP3
SCHEMBL6114438 0.89 LMNA (0.75) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL17079319 0.89 LMNA (0.75) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL20202525 0.89 MAPT (0.60) MAPTMAPK1LMNAKDM4EDUSP3
SCHEMBL14305782 0.88 LMNA (0.73) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL25635327 0.87 MAPT (0.52) MAPTMAPK1LMNAKDM4EDUSP3
SCHEMBL4567275 0.85 DGKA (0.70) MAPTMAPK1LMNAKDM4EDUSP3
SCHEMBL6968513 0.85 DGKA (0.70) MAPTMAPK1LMNAKDM4EDUSP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1079918-A1 MICROENCAPSULATION AND ELECTROSTATIC PROCESSING METHOD NASA/Johnson Space Center (US) 2001-03-07 EP disclosed
WO-1999059714-A1 MICROENCAPSULATION AND ELECTROSTATIC PROCESSING METHOD NASA/JOHNSON SPACE CENTER (US) 1999-11-25 WO disclosed