SCHEMBL8961767

SCHEMBL8961767

CCCOc1ccc(-c2ccc(-c3ccc(C4CCC(C5CCC(CCC)CC5)CC4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 8/20 0.36
ALOX5AP P20292 5/20 0.32
FEN1 P39748 5/20 0.32
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31
HTR2C P28335 2/20 0.31
HTR2B P41595 2/20 0.31
HTR2A P28223 1/20 0.31
FFAR4 Q5NUL3 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL8934891 0.97 FPR2 (0.37) FPR2ALOX5APFEN1GABRA1GABRB2
SCHEMBL8961771 0.95 SCN9A (0.32) FPR2ALOX5APFEN1HTR2C
SCHEMBL8961770 0.94 FPR2 (0.33) FPR2ALOX5APFEN1
SCHEMBL8961764 0.93 FPR2 (0.34) FPR2ALOX5APFEN1FFAR4CYP2C9
SCHEMBL8961809 0.93 FPR2 (0.32) FPR2ALOX5APFEN1
SCHEMBL8961814 0.93 FPR2 (0.32) FPR2ALOX5APFEN1
SCHEMBL8961785 0.93 FPR2 (0.32) FPR2ALOX5APFEN1
SCHEMBL8961936 0.93 FPR2 (0.34) FPR2ALOX5APFEN1GABRA1GABRB2
SCHEMBL8961839 0.93 FPR2 (0.32) FPR2ALOX5APFEN1
SCHEMBL12140864 0.92 HTR2C (0.35) FPR2HTR2CHTR2BHTR2ACYP2C9

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-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed