SCHEMBL14765840

SCHEMBL14765840

CCCCOc1ccc(-c2ccc(COC3CCC(c4ccc(OCCCC)cc4F)CC3)c(F)c2F)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 5/20 0.39
FFAR1 O14842 2/20 0.39
RARA P10276 1/20 0.35
RARB P10826 1/20 0.35
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
CRBN Q96SW2 1/20 0.34
S1PR1 P21453 2/20 0.34
S1PR3 Q99500 2/20 0.34
MCL1 Q07820 1/20 0.34
CNR2 P34972 5/20 0.33
CNR1 P21554 3/20 0.33
HTR2A P28223 1/20 0.33
NAAA Q02083 1/20 0.33
PTPN11 Q06124 1/20 0.33

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
SCHEMBL14765921 0.98 FFAR4 (0.38) FFAR4FFAR1RARARARBCHRM2
SCHEMBL14766100 0.98 FFAR4 (0.42) FFAR4FFAR1RARARARBCHRM2
SCHEMBL12736845 0.95 FFAR4 (0.36) FFAR4FFAR1CRBNS1PR1S1PR3
SCHEMBL14766281 0.94 FFAR4 (0.36) FFAR4FFAR1RARARARBCHRM2
SCHEMBL12736847 0.93 FFAR4 (0.35) FFAR4FFAR1CNR2CNR1HTR2A
SCHEMBL14766184 0.93 FFAR4 (0.35) FFAR4FFAR1RARARARBCHRM2
SCHEMBL14766186 0.93 FFAR4 (0.39) FFAR4FFAR1NAAA
SCHEMBL12736854 0.93 PTPN11 (0.36) FFAR4FFAR1CNR2CNR1HTR2A
SCHEMBL12736855 0.93 PTPN11 (0.36) FFAR4FFAR1CNR2CNR1HTR2A
SCHEMBL12736852 0.93 PTPN11 (0.36) FFAR4FFAR1CNR2CNR1HTR2A

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