SCHEMBL14766857

SCHEMBL14766857

CCCCOc1ccc(-c2ccc(-c3ccc(COc4ccc(OCC)cc4F)cc3)c(F)c2F)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 12/20 0.47
PPARD Q03181 6/20 0.47
FFAR4 Q5NUL3 2/20 0.46
S1PR1 P21453 2/20 0.41
S1PR3 Q99500 2/20 0.41
FAAH O00519 1/20 0.41
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
PTPN11 Q06124 1/20 0.39
RARA P10276 1/20 0.39
RARB P10826 1/20 0.39
BRD4 O60885 1/20 0.39
MCL1 Q07820 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL14766642 0.96 FFAR1 (0.43) FFAR1PPARDFFAR4S1PR1S1PR3
SCHEMBL14767010 0.95 FFAR1 (0.47) FFAR1PPARDFFAR4S1PR1S1PR3
SCHEMBL14766083 0.94 FFAR1 (0.46) FFAR1PPARDFFAR4S1PR1S1PR3
SCHEMBL14767244 0.94 FFAR1 (0.46) FFAR1PPARDFFAR4S1PR1S1PR3
SCHEMBL14766865 0.94 FFAR1 (0.52) FFAR1PPARDFFAR4PPARGPPARA
SCHEMBL14766750 0.93 FFAR1 (0.45) FFAR1PPARDFFAR4S1PR1S1PR3
SCHEMBL14766382 0.92 S1PR1 (0.46) FFAR1PPARDFFAR4S1PR1S1PR3
SCHEMBL14766080 0.91 RARA (0.45) FFAR1PPARDFFAR4S1PR1S1PR3
SCHEMBL12741008 0.91 FFAR1 (0.44) FFAR1PPARDFFAR4S1PR1S1PR3
SCHEMBL14767148 0.91 FFAR1 (0.48) FFAR1PPARDFFAR4S1PR1S1PR3

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