SCHEMBL15316595

SCHEMBL15316595

CCCC1C=CC(C2CCC(c3ccc(-c4ccc(C)c(F)c4F)cc3)CC2)CC1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
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
SCHEMBL15316586 0.93 SPHK1 (0.31)
SCHEMBL15316596 0.88
SCHEMBL15316576 0.87 CYP2C9 (0.38) CYP2C9
SCHEMBL15221011 0.86 FPR2 (0.33)
SCHEMBL15316573 0.84
SCHEMBL19775724 0.82 CYP2C9 (0.32) CYP2C9
SCHEMBL17621121 0.82 CYP2C9 (0.44) CYP2C9
SCHEMBL15316562 0.81
SCHEMBL15316597 0.81
SCHEMBL15316583 0.81 FFAR4 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9090825-B2 Cyclohexene-3,6-diyl compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-07-28 US disclosed
US-8956552-B2 Cyclohexene-3,6-diyl compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-02-17 US disclosed
US-20130270480-A1 CYCLOHEXENE-3,6-DIYL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION 2013-10-17 US disclosed