SCHEMBL14765823

SCHEMBL14765823

CCCCOc1ccc(C2CCC(c3ccc(-c4ccc(OCCC)cc4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.41
FFAR1 O14842 1/20 0.41
RARA P10276 1/20 0.38
RARB P10826 1/20 0.38
CHRM2 P08172 2/20 0.38
CHRM4 P08173 2/20 0.38
CHRM5 P08912 2/20 0.38
CHRM1 P11229 2/20 0.38
CHRM3 P20309 2/20 0.38
CRBN Q96SW2 1/20 0.37
MCL1 Q07820 1/20 0.37
CYP2D6 P10635 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
S1PR1 P21453 2/20 0.37
S1PR3 Q99500 2/20 0.37
PTPN11 Q06124 1/20 0.36
MAOB P27338 1/20 0.36
ACACB O00763 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL12733957 0.92 FFAR4 (0.38) FFAR4FFAR1RARARARBCHRM2
SCHEMBL12733959 0.90 PTPN11 (0.39) FFAR4FFAR1RARARARBCRBN
SCHEMBL14765798 0.90 FFAR4 (0.39) FFAR4FFAR1RARARARBCHRM2
SCHEMBL14765690 0.90 FFAR4 (0.37) FFAR4FFAR1RARARARBCHRM2
SCHEMBL12733962 0.89 PTPN11 (0.40) FFAR4FFAR1CRBNMCL1S1PR1
SCHEMBL12733960 0.89 PTPN11 (0.40) FFAR4FFAR1CRBNMCL1S1PR1
SCHEMBL14765686 0.88 FFAR4 (0.44) FFAR4FFAR1
SCHEMBL14766384 0.88 FFAR4 (0.37) FFAR4FFAR1RARARARBCHRM2
SCHEMBL14766679 0.88 FFAR4 (0.37) FFAR4FFAR1RARARARBCHRM2
SCHEMBL14765921 0.88 FFAR4 (0.38) FFAR4FFAR1RARARARBCHRM2

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