SCHEMBL14767296

SCHEMBL14767296

C=CCCOc1ccc(OC(=O)c2ccc(-c3ccc(C4CCC(OCC)CC4)c(F)c3F)cc2)cc1F

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 3/20 0.34
▸ FEN1 P39748 3/20 0.34
▸ FFAR4 Q5NUL3 9/20 0.31
▸ FFAR1 O14842 2/20 0.31
▸ PPARD Q03181 2/20 0.31
▸ SCN9A Q15858 1/20 0.31
▸ CCNC P24863 1/20 0.30
▸ CDK8 P49336 1/20 0.30
▸ SSTR5 P35346 1/20 0.30

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
SCHEMBL14767212 0.95 SCN9A (0.34) ALOX5APFEN1FFAR4PPARDSCN9A
SCHEMBL14767274 0.95 ALOX5AP (0.33) ALOX5APFEN1FFAR4SCN9ASSTR5
SCHEMBL14766947 0.94 ALOX5AP (0.36) ALOX5APFEN1FFAR4FFAR1PPARD
SCHEMBL14767146 0.93 ALOX5AP (0.33) ALOX5APFEN1FFAR4PPARDSCN9A
SCHEMBL14766843 0.93 GYS1 (0.36) ALOX5APFEN1FFAR4FFAR1PPARD
SCHEMBL12742552 0.92 ALOX5AP (0.35) ALOX5APFEN1FFAR4FFAR1PPARD
SCHEMBL14767097 0.91 ALOX5AP (0.38) ALOX5APFEN1FFAR4FFAR1PPARD
SCHEMBL14767222 0.91 SCN9A (0.34) ALOX5APFEN1FFAR4PPARDSCN9A
SCHEMBL14766704 0.91 ALOX5AP (0.34) ALOX5APFEN1FFAR4FFAR1PPARD
SCHEMBL14766972 0.90 ALOX5AP (0.39) ALOX5APFEN1CCNCCDK8

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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