SCHEMBL14766942

SCHEMBL14766942

C=CCCOc1ccc(COc2ccc(-c3ccc(-c4ccc(OCCCC)cc4)c(F)c3F)cc2)cc1F

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.43
CNR1 P21554 1/20 0.40
FFAR1 O14842 9/20 0.39
PPARD Q03181 7/20 0.39
PPARA Q07869 4/20 0.39
PPARG P37231 2/20 0.39
FAAH O00519 1/20 0.38
S1PR1 P21453 3/20 0.36
RARA P10276 1/20 0.36
RARB P10826 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
S1PR3 Q99500 2/20 0.35
S1PR2 O95136 1/20 0.35
LPAR2 Q9HBW0 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
SCHEMBL14767000 0.96 CNR2 (0.43) CNR2CNR1FFAR1PPARDPPARA
SCHEMBL14766912 0.95 CNR2 (0.42) CNR2CNR1FFAR1PPARDFAAH
SCHEMBL14766800 0.93 FFAR1 (0.46) CNR2CNR1FFAR1PPARDPPARA
SCHEMBL14767024 0.92 CNR2 (0.43) CNR2CNR1FFAR1FAAHS1PR1
SCHEMBL14766860 0.92 CNR2 (0.40) CNR2CNR1FFAR1PPARDFAAH
SCHEMBL14766898 0.91 FFAR1 (0.43) FFAR1PPARDPPARAPPARGFAAH
SCHEMBL14767298 0.91 CNR2 (0.42) CNR2CNR1FFAR1PPARDPPARA
SCHEMBL12740541 0.91 FFAR1 (0.39) CNR1FFAR1PPARDPPARAPPARG
SCHEMBL14766147 0.90 CNR2 (0.40) CNR2CNR1FFAR1PPARDPPARA
SCHEMBL14766748 0.89 FFAR1 (0.46) FFAR1PPARDPPARAPPARGFAAH

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