SCHEMBL15433422

SCHEMBL15433422

FC(F)=C(F)c1ccc(-c2cnc(C3CCC(c4cc(F)c(F)c(F)c4)CC3)nc2)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.34
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
FEN1 P39748 10/20 0.32
ALOX5AP P20292 7/20 0.32
HDAC4 P56524 1/20 0.31
CYP3A4 P08684 3/20 0.31
CYP2C9 P11712 2/20 0.31
APP P05067 2/20 0.31
FASN P49327 1/20 0.31
USP30 Q70CQ3 1/20 0.31
DHODH Q02127 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 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
SCHEMBL15433451 0.77 HDAC1 (0.35) FFAR4HDAC1HDAC6HDAC5FEN1
SCHEMBL15433841 0.75 CYP3A4 (0.37) CYP3A4CYP2C9APPFASNCYP2D6
SCHEMBL15433568 0.74 CYP2C9 (0.32) CYP2C9FASNUSP30
SCHEMBL15433418 0.74 ACACB (0.32) FFAR4FEN1ALOX5APHDAC4DHODH
SCHEMBL15433840 0.70 CYP3A4 (0.32) CYP3A4CYP2C9APPFASN
SCHEMBL15433180 0.70 RARB (0.36) CYP3A4CYP2C9APPFASNCYP2D6
SCHEMBL15433402 0.69 DGAT1 (0.31) FFAR4CYP3A4
SCHEMBL14946092 0.68 CYP2C9 (0.40) CYP3A4CYP2C9APPFASN
SCHEMBL15433193 0.66 OPRL1 (0.32)
SCHEMBL15433399 0.66 FASN (0.41) CYP3A4CYP2C9APPFASNCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8956551-B2 Liquid crystal compound having fluorovinyl group, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-02-17 US disclosed
US-8956551-B2 Liquid crystal compound having fluorovinyl group, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-02-17 US disclosed
US-20140021406-A1 LIQUID CRYSTAL COMPOUND HAVING FLUOROVINYL GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-01-23 US disclosed
US-20140021406-A1 LIQUID CRYSTAL COMPOUND HAVING FLUOROVINYL GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-01-23 US disclosed