SCHEMBL14766614

SCHEMBL14766614

CCCCOc1ccc(COc2ccc(-c3ccc(C4CCC(OCCCC)CC4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 7/20 0.39
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
ESR1 P03372 1/20 0.30
SCN9A Q15858 1/20 0.30
NAAA Q02083 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
SCHEMBL14766488 1.00 FFAR4 (0.39) FFAR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL14766256 0.97 FFAR4 (0.38) FFAR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL14766741 0.97 FFAR4 (0.38) FFAR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL14766193 0.97 FFAR4 (0.38) FFAR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL14766993 0.97 FFAR4 (0.38) FFAR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL14766842 0.94 FFAR4 (0.36) FFAR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL14765890 0.94 FFAR4 (0.36) FFAR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL14765939 0.94 FFAR4 (0.35) FFAR4
SCHEMBL14766739 0.94 FFAR4 (0.35) FFAR4
SCHEMBL14766738 0.93 FFAR4 (0.35) FFAR4

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-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed