SCHEMBL14766679

SCHEMBL14766679

CCCCOc1ccc(COC2CCC(c3ccc(-c4ccc(OCCC)cc4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 4/20 0.37
FFAR1 O14842 3/20 0.36
NAAA Q02083 3/20 0.36
S1PR1 P21453 2/20 0.35
S1PR3 Q99500 2/20 0.35
HTR2A P28223 2/20 0.34
RARA P10276 1/20 0.34
RARB P10826 1/20 0.34
CRBN Q96SW2 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
MCL1 Q07820 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
ACACB O00763 1/20 0.32
ACACA Q13085 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL14767129 0.98 FFAR4 (0.38) FFAR4FFAR1NAAAS1PR1S1PR3
SCHEMBL14766606 0.96 FFAR4 (0.40) FFAR4FFAR1NAAAS1PR1S1PR3
SCHEMBL14766709 0.94 FFAR4 (0.39) FFAR4FFAR1NAAAS1PR1S1PR3
SCHEMBL12740364 0.93 FFAR4 (0.36) FFAR4FFAR1NAAAS1PR1S1PR3
SCHEMBL14766856 0.93 FFAR4 (0.40) FFAR4FFAR1NAAAS1PR1S1PR3
SCHEMBL14765921 0.92 FFAR4 (0.38) FFAR4FFAR1NAAAS1PR1S1PR3
SCHEMBL14766732 0.92 FFAR4 (0.34) FFAR4FFAR1NAAAS1PR1S1PR3
SCHEMBL12740365 0.92 FFAR4 (0.35) FFAR4FFAR1NAAAS1PR1S1PR3
SCHEMBL14767254 0.91 FFAR4 (0.34) FFAR4FFAR1NAAAS1PR1S1PR3
SCHEMBL14767021 0.91 NAAA (0.40) FFAR4FFAR1NAAAALOX5APFEN1

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