SCHEMBL7514412

SCHEMBL7514412

CC(=O)Nc1ncc(SC(C)=O)s1.CC(=O)Nc1ncc(SCc2nc(C)c(C)o2)s1

nearest known ligand 0.89

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 20/20 0.89
CDK2 P24941 20/20 0.89
CCNE2 O96020 19/20 0.89
CDK4 P11802 13/20 0.64
CCND1 P24385 12/20 0.64
CDK1 P06493 10/20 0.59
CCNB2 O95067 9/20 0.59
CCNB1 P14635 9/20 0.59
CCNB3 Q8WWL7 9/20 0.59
CCND2 P30279 1/20 0.59
CCND3 P30281 1/20 0.59

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
SCHEMBL4991701 0.94 CCNE1 (1.00) CCNE1CDK2CCNE2CDK4CCND1
SCHEMBL5216840 0.79 CCNE1 (0.67) CCNE1CDK2CCNE2CDK4CCND1
SCHEMBL7514415 0.75 CDK2 (0.52) CCNE1CDK2CCNE2CDK4CCND1
SCHEMBL6695938 0.75 CCNE2 (0.76) CCNE1CDK2CCNE2CDK4CCND1
SCHEMBL5213819 0.74 CCNE2 (1.00) CCNE1CDK2CCNE2CDK4CCND1
SCHEMBL4734684 0.74 CCNE2 (1.00) CCNE1CDK2CCNE2CDK4CCND1
SCHEMBL4731497 0.73 CDK2 (1.00) CCNE1CDK2CCNE2CDK4CCND1
SCHEMBL14040956 0.73 CCNE2 (0.83) CCNE1CDK2CCNE2CDK4CCND1
SCHEMBL5213493 0.71 CCNE2 (0.80) CCNE1CDK2CCNE2CDK4CCND1
SCHEMBL16731888 0.71 CCNE1 (0.68) CCNE1CDK2CCNE2CDK4CCND1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1240153-A1 AMINOTHIAZOLE INHIBITORS OF CYCLIN DEPENDENT KINASES Bristol-Myers Squibb Company (US) 2002-09-18 EP disclosed
WO-2001044217-A1 AMINOTHIAZOLE INHIBITORS OF CYCLIN DEPENDENT KINASES BRISTOL-MYERS SQUIBB CO. (US) 2001-06-21 WO disclosed