SCHEMBL9358161

SCHEMBL9358161

CCCCCCOc1ccc(CCC(=O)OCC)cc1-c1cc(CCC(=O)OCC)ccc1O

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.57
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
APP P05067 1/20 0.46
CNR1 P21554 3/20 0.46
CNR2 P34972 3/20 0.46
CYP4F2 P78329 1/20 0.45
CYP4A11 Q02928 1/20 0.45
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
HTR1A P08908 2/20 0.43
SMPD1 P17405 1/20 0.43
IAPP P10997 1/20 0.42
ESR1 P03372 2/20 0.42

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
SCHEMBL9358181 1.00 RXRA (0.57) RXRACYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL9362271 1.00 RXRA (0.57) RXRACYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL9362039 1.00 RXRA (0.57) RXRACYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL9362102 0.99 RXRA (0.58) RXRACYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL9357921 0.95 RXRA (0.56) RXRACYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL9357708 0.92 RXRA (0.49) RXRACYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL9357818 0.92 RXRA (0.49) RXRACYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL9357859 0.87 RXRA (0.72) RXRACYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL9358171 0.87 RXRA (0.72) RXRACYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL9681564 0.87 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