SCHEMBL15460813

SCHEMBL15460813

CCCCCCCCC1CCC(c2ccc(C(F)(F)Oc3ccc(-c4cc(F)c(OC=C(F)F)c(F)c4)c(F)c3)cc2)CC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 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
SCHEMBL15461042 0.93 CYP3A4 (0.31) CYP3A4CYP2C9
SCHEMBL15460791 0.90 ALDH1A1 (0.32) CYP2C9
SCHEMBL15461041 0.90 ALDH1A1 (0.33) CYP3A4CYP2C9
SCHEMBL15460858 0.89
SCHEMBL15460786 0.88 ALDH1A1 (0.32) CYP2C9
SCHEMBL13112233 0.87 CYP2C9 (0.33) CYP3A4CYP2C9
SCHEMBL12624087 0.85 CYP2C9 (0.36) CYP3A4CYP2C9
SCHEMBL15460617 0.84 ALDH1A1 (0.40) CYP2C9
SCHEMBL15460894 0.84
SCHEMBL12625026 0.84 CYP3A4 (0.35) CYP3A4CYP2C9

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