SCHEMBL14765798

SCHEMBL14765798

C=CCCCOc1ccc(C2CCC(c3ccc(-c4ccc(OCCCC)cc4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

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 2/20 0.34
CHRM4 P08173 2/20 0.34
CHRM5 P08912 2/20 0.34
CHRM1 P11229 2/20 0.34
CHRM3 P20309 2/20 0.34
CRBN Q96SW2 1/20 0.34
SLC10A2 Q12908 1/20 0.34
ALDH1A1 P00352 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
S1PR1 P21453 2/20 0.34
S1PR3 Q99500 2/20 0.34
MCL1 Q07820 1/20 0.34
ALDH2 P05091 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 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
SCHEMBL14765690 0.96 FFAR4 (0.37) FFAR4FFAR1RARARARBCHRM2
SCHEMBL14765684 0.92 FFAR4 (0.41) FFAR4FFAR1ALDH1A1NPC1LMNA
SCHEMBL12733968 0.92 FFAR4 (0.35) FFAR4FFAR1ALDH1A1L3MBTL1ALDH2
SCHEMBL14766555 0.90 FFAR1 (0.35) FFAR4FFAR1RARARARBCRBN
SCHEMBL14766281 0.90 FFAR4 (0.36) FFAR4FFAR1RARARARBCHRM2
SCHEMBL14766732 0.90 FFAR4 (0.34) FFAR4FFAR1RARARARBCHRM2
SCHEMBL14765823 0.90 FFAR4 (0.41) FFAR4FFAR1RARARARBCHRM2
SCHEMBL14766397 0.89 FFAR4 (0.34) FFAR4FFAR1RARARARBCHRM2
SCHEMBL14767125 0.89 FFAR1 (0.38) FFAR4FFAR1SLC10A2
SCHEMBL12822695 0.88 FFAR4 (0.34) FFAR4FFAR1CRBNSLC10A2S1PR1

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