SCHEMBL14767238

SCHEMBL14767238

C=CCCOc1ccc(OCc2ccc(-c3ccc(-c4ccc(OCC)cc4)c(F)c3F)cc2)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 17/20 0.44
PPARD Q03181 9/20 0.44
FFAR4 Q5NUL3 2/20 0.40
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
PTGES O14684 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
CNR2 P34972 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 0.96 FFAR1 (0.46) FFAR1PPARDFFAR4PPARGPPARA
SCHEMBL14766182 0.95 FFAR1 (0.40) FFAR1PPARDFFAR4PPARGPPARA
SCHEMBL14766860 0.94 CNR2 (0.40) FFAR1PPARDFFAR4PTGESCNR2
SCHEMBL14766499 0.92 FFAR1 (0.43) FFAR1PPARDFFAR4PPARGPPARA
SCHEMBL14766654 0.92 CNR2 (0.40) FFAR1PPARDFFAR4PPARGPPARA
SCHEMBL14766912 0.91 CNR2 (0.42) FFAR1PPARDPTGESCNR2
SCHEMBL14766800 0.91 FFAR1 (0.46) FFAR1PPARDFFAR4PPARGPPARA
SCHEMBL12741029 0.91 FFAR4 (0.41) FFAR1PPARDFFAR4MAPTMAPK1
SCHEMBL14765879 0.90 CNR2 (0.37) FFAR1PPARDFFAR4PPARGPPARA
SCHEMBL14767195 0.90 CNR2 (0.37) FFAR1PPARDFFAR4PPARGPPARA

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