SCHEMBL14766281

SCHEMBL14766281

C=CCCCOc1ccc(C2CCC(OCc3ccc(-c4ccc(OCCCC)cc4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 4/20 0.36
FFAR1 O14842 2/20 0.35
ALDH2 P05091 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
RARA P10276 1/20 0.32
RARB P10826 1/20 0.32
SLC10A2 Q12908 1/20 0.32
CRBN Q96SW2 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
S1PR1 P21453 2/20 0.31
S1PR3 Q99500 2/20 0.31
MCL1 Q07820 1/20 0.31
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL14766184 0.97 FFAR4 (0.35) FFAR4FFAR1RARARARBCRBN
SCHEMBL14765840 0.94 FFAR4 (0.39) FFAR4FFAR1RARARARBCRBN
SCHEMBL12736861 0.93 FFAR4 (0.34) FFAR4FFAR1ALDH2MAOAMAOB
SCHEMBL14766191 0.93 FFAR4 (0.37) FFAR4FFAR1NAAA
SCHEMBL14766732 0.93 FFAR4 (0.34) FFAR4FFAR1ALDH2MAOAMAOB
SCHEMBL14766100 0.92 FFAR4 (0.42) FFAR4FFAR1RARARARBCRBN
SCHEMBL14765921 0.92 FFAR4 (0.38) FFAR4FFAR1RARARARBCRBN
SCHEMBL14767254 0.90 FFAR4 (0.34) FFAR4FFAR1RARARARBCRBN
SCHEMBL14766269 0.90 SLC10A2 (0.33) FFAR1SLC10A2CRBNCNR2CNR1
SCHEMBL14765798 0.90 FFAR4 (0.39) FFAR4FFAR1ALDH2MAOAMAOB

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