SCHEMBL15433178

SCHEMBL15433178

C/C(F)=C(\F)c1ccc(-c2ccc(-c3cc(F)c(F)c(F)c3)cc2)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.37
ANPEP P15144 11/20 0.36
KIF11 P52732 1/20 0.35
APP P05067 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
ADH5 P11766 1/20 0.34
CYP17A1 P05093 1/20 0.33
CYP19A1 P11511 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32

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
SCHEMBL15433668 0.92 KIF11 (0.34) RARBANPEPKIF11APPCYP3A4
SCHEMBL15433172 0.89 KIF11 (0.39) RARBANPEPKIF11APPCYP3A4
SCHEMBL15433180 0.87 RARB (0.36) RARBANPEPAPPCYP3A4CYP2C9
SCHEMBL15433176 0.87 ANPEP (0.41) ANPEPKIF11CYP3A4CYP17A1CYP19A1
SCHEMBL15433381 0.87 ANPEP (0.41) ANPEPKIF11CYP3A4CYP17A1CYP19A1
SCHEMBL15433678 0.85 RARB (0.45) RARBESR1ESR2
SCHEMBL15433181 0.84 RARB (0.40) RARBANPEPAPPCYP3A4CYP2C9
SCHEMBL15433401 0.84 KIF11 (0.35) RARBANPEPKIF11APPCYP3A4
SCHEMBL15433382 0.84 RARB (0.33) RARBANPEPAPPCYP3A4CYP2C9
SCHEMBL15433185 0.84 RARB (0.33) RARBANPEPAPPCYP3A4CYP2C9

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