SCHEMBL9303672

SCHEMBL9303672

CC(=CCCC1(C)CCc2cc(O[Si](C)(C)C(C)(C)C)c(C)c(C)c2O1)CCl

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 12/20 0.53
PTGES O14684 2/20 0.49
PPARG P37231 4/20 0.47
PPARA Q07869 4/20 0.47
NR1I2 O75469 1/20 0.47
AKT1 P31749 1/20 0.44

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
SCHEMBL9303661 1.00 ALOX5 (0.53) ALOX5PTGESPPARGPPARANR1I2
SCHEMBL9303437 0.91 ALOX5 (0.58) ALOX5PTGESPPARGPPARANR1I2
SCHEMBL9304263 0.91 ALOX5 (0.58) ALOX5PTGESPPARGPPARANR1I2
SCHEMBL16583032 0.91 ALOX5 (0.58) ALOX5PTGESPPARGPPARANR1I2
SCHEMBL9303231 0.90 ALOX5 (0.52) ALOX5PTGESPPARGPPARANR1I2
SCHEMBL16583051 0.87 ALOX5 (0.65) ALOX5PTGESPPARGPPARANR1I2
SCHEMBL20819466 0.85 ALOX5 (0.54) ALOX5PTGESPPARGPPARANR1I2
SCHEMBL16583013 0.84 AKT1 (0.48) ALOX5PTGESPPARGPPARANR1I2
SCHEMBL16583014 0.84 AKT1 (0.48) ALOX5PTGESPPARGPPARANR1I2
SCHEMBL16583070 0.82 ALOX5 (0.47) ALOX5PTGESPPARGPPARANR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5318993-A Antihyperlipidemic benzoquinones BRISTOL-MYERS SQUIBB COMPANY (US) 1994-06-07 US disclosed