SCHEMBL5835937

SCHEMBL5835937

CC(C)c1cnc(NC(=O)Cc2ccsc2)s1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 12/20 0.71
CCNE1 P24864 11/20 0.71
CDK5 Q00535 11/20 0.71
SMN1; SMN2 Q16637 2/20 0.71
CCNT1 O60563 1/20 0.71
ALDH1A1 P00352 1/20 0.71
CDK1 P06493 1/20 0.71
CDK4 P11802 1/20 0.71
CCNB1 P14635 1/20 0.71
CCNA2 P20248 1/20 0.71
CCND1 P24385 1/20 0.71
CDK7 P50613 1/20 0.71
CDK9 P50750 1/20 0.71
CCNH P51946 1/20 0.71
MNAT1 P51948 1/20 0.71
CDK5R1 Q15078 1/20 0.71
GLS O94925 2/20 0.53
PSEN1 P49768 1/20 0.48
PSEN2 P49810 1/20 0.48
APH1B Q8WW43 1/20 0.48

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
SCHEMBL5481055 0.93 CDK2 (0.66) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL5485376 0.90 CCNE1 (0.59) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL28747888 0.89 CDK2 (0.57) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL27567511 0.85 CDK2 (0.53) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL27570480 0.84 CCNE1 (0.55) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL27570477 0.84 CCNE1 (0.66) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL1535301 0.83 CCNE1 (1.00) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL27586859 0.83 CDK2 (0.51) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL27567526 0.83 CCNE1 (0.51) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL27586856 0.83 CCNE1 (0.51) CDK2CCNE1CDK5SMN1; SMN2CCNT1

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