SCHEMBL15460641

SCHEMBL15460641

CCCc1ccc(-c2ccc(C(F)(F)Oc3ccc(-c4cc(F)c(OC=C(F)F)c(F)c4)c(F)c3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 2/20 0.35
S1PR3 Q99500 2/20 0.35
GRM2 Q14416 1/20 0.33
RARB P10826 1/20 0.32
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
ERN1 O75460 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
SCHEMBL15461299 0.94 S1PR1 (0.35) S1PR1S1PR3GRM2RARB
SCHEMBL15461326 0.94 RARB (0.41) S1PR1S1PR3GRM2RARB
SCHEMBL15460687 0.91 RARB (0.40) S1PR1S1PR3GRM2RARBFFAR1
SCHEMBL15461310 0.91 PPARG (0.33) RARB
SCHEMBL15460642 0.91 MAOB (0.32) RARB
SCHEMBL15461297 0.91 MAOB (0.32) RARB
SCHEMBL15460815 0.91 KIF11 (0.34) S1PR1S1PR3GRM2RARBALOX5AP
SCHEMBL15461318 0.90 S1PR1 (0.34) S1PR1S1PR3GRM2RARBALOX5AP
SCHEMBL15460636 0.89 S1PR1 (0.33) S1PR1S1PR3RARB
SCHEMBL15461321 0.88 RARB (0.31) RARB

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-9273245-B2 Compound having 2,2-difluorovinyloxy group or 1,2,2-trifluorovinyloxy group, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-03-01 US disclosed
US-9273245-B2 Compound having 2,2-difluorovinyloxy group or 1,2,2-trifluorovinyloxy group, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-03-01 US disclosed
US-20140034876-A1 COMPOUND HAVING 2,2-DIFLUOROVINYLOXY GROUP OR 1,2,2-TRIFLUOROVINYLOXY GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-02-06 US disclosed
US-20140034876-A1 COMPOUND HAVING 2,2-DIFLUOROVINYLOXY GROUP OR 1,2,2-TRIFLUOROVINYLOXY GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-02-06 US disclosed