SCHEMBL15460774

SCHEMBL15460774

CCC1CCC(c2ccc(-c3ccc(C(F)(F)Oc4ccc(OC=C(F)F)c(F)c4)cc3)cc2)CC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.33
SOAT1 P35610 1/20 0.33
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 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
SCHEMBL15460775 0.88
SCHEMBL15460778 0.85 CYP2C9 (0.35) CYP2C9
SCHEMBL7734839 0.83 PDE2A (0.38)
SCHEMBL7734834 0.83 PDE2A (0.38)
SCHEMBL15460628 0.82 ALDH1A1 (0.38) DGAT1SOAT1CYP3A4CYP2C9
SCHEMBL7722845 0.81 IDO1 (0.35) CYP2C9
SCHEMBL7722850 0.81 IDO1 (0.35) CYP2C9
SCHEMBL15461037 0.81
SCHEMBL16789616 0.81 DGAT1 (0.36) DGAT1SOAT1CYP3A4CYP2C9
SCHEMBL7730587 0.81 ALDH1A1 (0.34) DGAT1SOAT1CYP3A4CYP2C9

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