SCHEMBL8767480

SCHEMBL8767480

Cc1c(C)c2c(c(C)c1O)CCC(C)(CCCc1ccc(OC(C)(C)C(=O)O)cc1)O2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.51
NR1I2 O75469 2/20 0.51
MAPT P10636 3/20 0.48
LMNA P02545 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
GSTP1 P09211 1/20 0.48
TTPA P49638 1/20 0.48
USP2 O75604 1/20 0.48
THRB P10828 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
PPARA Q07869 1/20 0.47
TDP1 Q9NUW8 1/20 0.46
CYP4F2 P78329 1/20 0.45
PPARG P37231 1/20 0.44
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43

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
SCHEMBL8767474 1.00 ALOX5 (0.51) ALOX5NR1I2MAPTLMNAMEN1
SCHEMBL8768719 0.96 ALOX5 (0.49) ALOX5NR1I2MAPTLMNAMEN1
SCHEMBL8768724 0.96 ALOX5 (0.49) ALOX5NR1I2MAPTLMNAMEN1
SCHEMBL8923422 0.86 ALOX5 (0.47) ALOX5NR1I2MAPTLMNAMEN1
SCHEMBL8923418 0.86 ALOX5 (0.47) ALOX5NR1I2MAPTLMNAMEN1
SCHEMBL8925722 0.85 PSEN1 (0.44) MAPTMEN1KMT2APPARATDP1
SCHEMBL8925726 0.85 PSEN1 (0.44) MAPTMEN1KMT2APPARATDP1
SCHEMBL8924155 0.83 PPARA (0.42) ALOX5MAPTMEN1KMT2APPARA
SCHEMBL8924165 0.83 PPARA (0.42) ALOX5MAPTMEN1KMT2APPARA
SCHEMBL8767394 0.79 PTGS1 (0.43) ALOX5MAPTMEN1KMT2APPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0621255-B1 Substituted phenoxy-isobutyric acids and esters ADIR (FR) 1997-08-20 EP claimed
US-5627205-A ANTILIPEMIC AGENTS AND ANTIOXIDANTS ADIR ET COMPAGNIE (FR) 1997-05-06 US claimed
EP-0621255-A1 Substituted phenoxy-isobutyric acids and esters ADIR ET COMPAGNIE (FR) 1994-10-26 EP claimed
US-5627205-A ANTILIPEMIC AGENTS AND ANTIOXIDANTS ADIR ET COMPAGNIE (FR) 1997-05-06 US disclosed