SCHEMBL13412059

SCHEMBL13412059

C/C=C/CCc1ccc(-c2ccc(-c3cc(F)c(OC(F)F)c(F)c3)c(F)c2)c(F)c1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 3/20 0.31
FEN1 P39748 3/20 0.31
SCN9A Q15858 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
SCHEMBL13412055 0.93 RARB (0.31)
SCHEMBL13412043 0.85 ALOX5AP (0.30) ALOX5APFEN1
SCHEMBL13412056 0.83 CHKA (0.33) ALOX5APFEN1
SCHEMBL13412057 0.83 ALOX5AP (0.34) ALOX5APFEN1
SCHEMBL13412060 0.81 CHKA (0.34) ALOX5APFEN1
SCHEMBL12624015 0.81 KIF11 (0.32) ALOX5APFEN1
SCHEMBL18310522 0.79 RARB (0.31)
SCHEMBL13412041 0.78 TAAR1 (0.31)
SCHEMBL9221537 0.78 DRD1 (0.36)
SCHEMBL9221535 0.78 DRD1 (0.36)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7674508-B2 Liquid crystal composition and liquid crystal display device CHISSO CORPORATION (JP) 2010-03-09 US disclosed
US-20080099726-A1 Liquid crystal composition and liquid crystal display device CHISSO CORPORATION AND CHISSO PETROCHEMICAL CORPORATION 2008-05-01 US disclosed