SCHEMBL14765936

SCHEMBL14765936

CCCCOc1ccc(-c2ccc(CCC3CCC(c4ccc(OCCCC)c(F)c4)CC3)c(F)c2F)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.38
▸ PPARG P37231 9/20 0.35
▸ PPARA Q07869 3/20 0.35
▸ S1PR1 P21453 1/20 0.34
▸ RAB9A P51151 1/20 0.33
▸ RARA P10276 1/20 0.33
▸ RARB P10826 1/20 0.33
▸ PPARD Q03181 1/20 0.33
▸ CHRM2 P08172 1/20 0.32
▸ CHRM4 P08173 1/20 0.32
▸ CHRM5 P08912 1/20 0.32
▸ CHRM1 P11229 1/20 0.32
▸ CHRM3 P20309 1/20 0.32
▸ KDM1A O60341 2/20 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
SCHEMBL14765940 0.98 FFAR4 (0.37) FFAR4PPARGPPARAS1PR1RAB9A
SCHEMBL14765984 0.96 KDM1A (0.38) FFAR4PPARGPPARARAB9ARARA
SCHEMBL12735144 0.94 FFAR4 (0.34) FFAR4PPARGPPARAS1PR1PPARD
SCHEMBL14766475 0.93 FFAR4 (0.34) FFAR4PPARGPPARAS1PR1
SCHEMBL14765986 0.93 FFAR4 (0.34) FFAR4PPARGPPARAS1PR1KDM1A
SCHEMBL12735147 0.91 S1PR1 (0.32) FFAR4S1PR1PPARDKDM1A
SCHEMBL14765726 0.91 KDM1A (0.40) FFAR4PPARDKDM1A
SCHEMBL12735159 0.90 S1PR1 (0.33) FFAR4S1PR1PPARDKDM1A
SCHEMBL12735154 0.90 S1PR1 (0.33) FFAR4S1PR1PPARDKDM1A
SCHEMBL12735156 0.90 S1PR1 (0.33) FFAR4S1PR1PPARDKDM1A

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
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