SCHEMBL15744238

SCHEMBL15744238

CCCC1COC(C2CCC(c3ccc(-c4cc(F)c(C5CO5)c(F)c4)c(F)c3)CC2)OC1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.31
FASN P49327 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
SCHEMBL15744583 0.88 CYP2C9 (0.32) CYP2C9FASN
SCHEMBL18310497 0.87
SCHEMBL15744499 0.87 CYP2C9 (0.30) CYP2C9
SCHEMBL15744801 0.85
SCHEMBL22448871 0.84 CYP2C9 (0.31) CYP2C9
SCHEMBL18314901 0.80 CYP2C9 (0.30) CYP2C9
SCHEMBL15744479 0.80 CYP2C9 (0.37) CYP2C9
SCHEMBL8389631 0.79 KDM5A (0.35) CYP2C9
SCHEMBL7029800 0.79 KDM5A (0.35) CYP2C9
SCHEMBL13614973 0.78 FASN (0.30) FASN

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
EP-2735599-A1 Liquid crystal compound having CF2OCF3 at terminal, liquid crystal composition and liquid crystal display device JNC Corporation (JP) 2014-05-28 EP disclosed