SCHEMBL5835407

SCHEMBL5835407

CC(C)c1cnc(NC(=O)c2ccc(OCc3ccccc3)cc2)s1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 5/20 0.72
CDK2 P24941 5/20 0.72
CDK5 Q00535 5/20 0.72
SMN1; SMN2 Q16637 3/20 0.61
ALDH1A1 P00352 2/20 0.61
CCNT1 O60563 1/20 0.61
CDK1 P06493 1/20 0.61
CDK4 P11802 1/20 0.61
CCNB1 P14635 1/20 0.61
CCNA2 P20248 1/20 0.61
CCND1 P24385 1/20 0.61
CDK7 P50613 1/20 0.61
CDK9 P50750 1/20 0.61
CCNH P51946 1/20 0.61
MNAT1 P51948 1/20 0.61
CDK5R1 Q15078 1/20 0.61
CSNK2A2 P19784 2/20 0.57
CSNK2A1 P68400 2/20 0.57
SCD O00767 1/20 0.57
RAB9A P51151 4/20 0.54

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
SCHEMBL5835952 0.86 CCNE1 (0.61) CCNE1CDK2CDK5SMN1; SMN2ALDH1A1
SCHEMBL5836464 0.86 CCNE1 (0.79) CCNE1CDK2CDK5SMN1; SMN2ALDH1A1
SCHEMBL6279215 0.86 CCNE1 (0.72) CCNE1CDK2CDK5SMN1; SMN2ALDH1A1
SCHEMBL5836073 0.85 CCNE1 (0.68) CCNE1CDK2CDK5SMN1; SMN2ALDH1A1
SCHEMBL5836102 0.84 CDK2 (1.00) CCNE1CDK2CDK5SMN1; SMN2ALDH1A1
SCHEMBL5836176 0.83 CCNE1 (0.65) CCNE1CDK2CDK5SMN1; SMN2ALDH1A1
SCHEMBL5835807 0.83 CCNE1 (0.65) CCNE1CDK2CDK5SMN1; SMN2ALDH1A1
SCHEMBL5835991 0.82 CCNE1 (0.71) CCNE1CDK2CDK5SMN1; SMN2CSNK2A2
SCHEMBL5835810 0.82 CDK2 (0.85) CCNE1CDK2CDK5SMN1; SMN2ALDH1A1
SCHEMBL5836732 0.81 CDK2 (0.79) CCNE1CDK2CDK5SMN1; SMN2ALDH1A1

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