SCHEMBL7883182

SCHEMBL7883182

COCCCNS(=O)(=O)c1cc(C#N)ccc1[C@H]1NC(=O)N(c2cccc(CF)c2)C(C)=C1C#N

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ELANE P08246 20/20 0.55
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.39

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
SCHEMBL15866539 0.91 ELANE (0.56) ELANECYP2C9CYP2C19
SCHEMBL2117972 0.89 ELANE (0.72) ELANECYP2C9CYP2C19
SCHEMBL2631132 0.84 ELANE (0.63) ELANECYP2C9CYP2C19
SCHEMBL2631138 0.83 ELANE (0.65) ELANECYP2C9CYP2C19
SCHEMBL15473114 0.82 ELANE (0.61) ELANECYP2C9CYP2C19
SCHEMBL15473108 0.82 ELANE (0.61) ELANECYP2C9CYP2C19
SCHEMBL15473056 0.82 ELANE (0.61) ELANECYP2C9CYP2C19
SCHEMBL15473107 0.82 ELANE (0.62) ELANECYP2C9
SCHEMBL15473026 0.82 ELANE (0.62) ELANECYP2C9
SCHEMBL15473084 0.82 ELANE (0.61) ELANECYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010115548-A1 SULFONIC AMIDE AND SULFOXIMINE-SUBSTITUTED DIARYL-DIHYDROPYRIMIDINONES AND USAGE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-10-14 WO disclosed