SCHEMBL9358192

SCHEMBL9358192

CCCCCCCCOc1ccc(CCCC(=O)OC)cc1-c1cc(CCCC(=O)OC)ccc1O

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.54
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C8 P10632 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2B6 P20813 1/20 0.47
CYP2C19 P33261 1/20 0.47
PPARG P37231 2/20 0.47
PPARA Q07869 1/20 0.47
CNR1 P21554 4/20 0.46
CNR2 P34972 3/20 0.46
SMPD1 P17405 1/20 0.46
KAT8 Q9H7Z6 2/20 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
SCHEMBL9358203 1.00 RXRA (0.54) RXRACYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL9680935 0.95 RXRA (0.53) RXRACYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL9680956 0.93 RXRA (0.48) RXRACYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL8984878 0.93 PPARG (0.49) RXRAPPARGPPARACNR2SMPD1
SCHEMBL9680898 0.88 MAPT (0.47) RXRACYP1A2CYP3A4CYP2C19CNR1
SCHEMBL9681186 0.88 CNR1 (0.44) RXRACYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL8984886 0.87 MAPT (0.49) CYP1A2CYP3A4CYP2C19PPARGPPARA
SCHEMBL9362344 0.85 HDAC1 (0.43) RXRACYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL9357859 0.85 RXRA (0.72) RXRACYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL9358171 0.85 RXRA (0.72) RXRACYP1A2CYP3A4CYP2C8CYP2C9

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-0470832-B1 Biphenyl 5,5'-bis-alkanoic acid derivatives, their production and use thereof ASAHI CHEMICAL IND (JP) 1994-12-14 EP disclosed
EP-0470832-A2 Biphenyl 5,5'-bis-alkanoic acid derivatives, their production and use thereof ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1992-02-12 EP disclosed