SCHEMBL124338

SCHEMBL124338

CSc1cc(C#N)ccc1[C@@H]1NC(=O)N(c2cccc(C(F)(F)F)c2)C(C)=C1OC(=O)O

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ELANE P08246 20/20 0.64
CYP2C9 P11712 4/20 0.60

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
SCHEMBL126645 1.00 ELANE (0.64) ELANECYP2C9
SCHEMBL126644 0.88 ELANE (0.68) ELANECYP2C9
SCHEMBL124337 0.88 ELANE (0.68) ELANECYP2C9
SCHEMBL123311 0.87 ELANE (0.57) ELANECYP2C9
SCHEMBL2617951 0.86 ELANE (0.74) ELANECYP2C9
SCHEMBL122466 0.86 ELANE (0.77) ELANECYP2C9
SCHEMBL3718411 0.86 ELANE (0.67) ELANECYP2C9
SCHEMBL124381 0.86 ELANE (0.67) ELANECYP2C9
SCHEMBL122018 0.85 ELANE (0.58) ELANECYP2C9
SCHEMBL122115 0.85 ELANE (0.58) ELANECYP2C9

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
EP-2417112-B1 SULFONIC AMIDE AND SULFOXIMINE-SUBSTITUTED DIARYL-DIHYDROPYRIMIDINONES AND USAGE THEREOF BAYER IP GMBH (DE) 2014-07-09 EP disclosed
EP-2234985-B1 4-(4-CYANO-2-THIOARYL)DIHYDROPYRIMIDINONES AND USE THEREOF Bayer Pharma AG (DE) 2012-03-07 EP disclosed
EP-2417112-A1 SULFONIC AMIDE AND SULFOXIMINE-SUBSTITUTED DIARYL-DIHYDROPYRIMIDINONES AND USAGE THEREOF Bayer Pharma Aktiengesellschaft (DE) 2012-02-15 EP disclosed
WO-2010115548-A1 SULFONIC AMIDE AND SULFOXIMINE-SUBSTITUTED DIARYL-DIHYDROPYRIMIDINONES AND USAGE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-10-14 WO disclosed