SCHEMBL5836788

SCHEMBL5836788

CC(C)c1cnc(NC(=O)c2cccc(Oc3ccccc3)c2)s1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 6/20 0.73
CDK2 P24941 6/20 0.73
CDK5 Q00535 6/20 0.73
GCK P35557 2/20 0.57
MEN1 O00255 1/20 0.54
CASP3 P42574 1/20 0.54
KMT2A Q03164 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54
KDR P35968 1/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
ALDH1A1 P00352 3/20 0.53
CCNT1 O60563 1/20 0.53
CDK1 P06493 1/20 0.53
CDK4 P11802 1/20 0.53
CCNB1 P14635 1/20 0.53
CCNA2 P20248 1/20 0.53
CCND1 P24385 1/20 0.53
CDK7 P50613 1/20 0.53

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
SCHEMBL5836464 0.90 CCNE1 (0.79) CCNE1CDK2CDK5MEN1CASP3
SCHEMBL5836282 0.88 CCNE1 (0.69) CCNE1CDK2CDK5MEN1KMT2A
SCHEMBL5836102 0.85 CDK2 (1.00) CCNE1CDK2CDK5MEN1KMT2A
SCHEMBL4756132 0.84 CCNE1 (0.63) CCNE1CDK2CDK5GCKMEN1
SCHEMBL5836142 0.82 CCNE1 (0.74) CCNE1CDK2CDK5MEN1KMT2A
SCHEMBL5835970 0.82 CCNE1 (0.74) CCNE1CDK2CDK5MEN1KMT2A
SCHEMBL5835428 0.81 CDK2 (0.72) CCNE1CDK2CDK5MEN1KMT2A
SCHEMBL5835431 0.81 CCNE1 (0.72) CCNE1CDK2CDK5MEN1CASP3
SCHEMBL5835396 0.81 CCNE1 (0.72) CCNE1CDK2CDK5MEN1KMT2A
SCHEMBL5836056 0.81 CCNE1 (0.72) CCNE1CDK2CDK5GCKMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7037929-B1 2-amino-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN S.P.A. (IT) 2006-05-02 US claimed
EP-1124810-B9 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-12-28 EP claimed
EP-1124810-B1 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-05-04 EP claimed
CN-1325389-A 2-aminothiazole derivatives, process for preparing the same and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2001-12-05 CN claimed
US-7037929-B1 2-amino-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN S.P.A. (IT) 2006-05-02 US disclosed
EP-1124810-B9 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-12-28 EP disclosed
EP-1124810-B1 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-05-04 EP disclosed
CN-1325389-A 2-aminothiazole derivatives, process for preparing the same and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2001-12-05 CN disclosed