SCHEMBL14766800

SCHEMBL14766800

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

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 13/20 0.46
PPARD Q03181 10/20 0.46
PPARA Q07869 4/20 0.46
PPARG P37231 2/20 0.46
CNR2 P34972 2/20 0.36
FFAR4 Q5NUL3 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
PTGES O14684 1/20 0.35
CNR1 P21554 1/20 0.34
GYS1 P13807 1/20 0.34

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
SCHEMBL14767082 0.95 FFAR1 (0.46) FFAR1PPARDPPARAPPARGCNR2
SCHEMBL14766942 0.93 CNR2 (0.43) FFAR1PPARDPPARAPPARGCNR2
SCHEMBL14766604 0.92 FFAR1 (0.38) FFAR1PPARDPPARAPPARGCNR2
SCHEMBL12740541 0.92 FFAR1 (0.39) FFAR1PPARDPPARAPPARGFFAR4
SCHEMBL14766499 0.91 FFAR1 (0.43) FFAR1PPARDPPARAPPARGCNR2
SCHEMBL14767000 0.91 CNR2 (0.43) FFAR1PPARDPPARAPPARGCNR2
SCHEMBL14767238 0.91 FFAR1 (0.44) FFAR1PPARDPPARAPPARGCNR2
SCHEMBL14766680 0.89 FFAR1 (0.48) FFAR1PPARDPPARAPPARGMAOA
SCHEMBL14765879 0.89 CNR2 (0.37) FFAR1PPARDPPARAPPARGCNR2
SCHEMBL14767195 0.89 CNR2 (0.37) FFAR1PPARDPPARAPPARGCNR2

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