SCHEMBL5835874

SCHEMBL5835874

CCCC(=O)Nc1ncc(CC/C(C)=N\N(C)C)s1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 3/20 0.46
CCNE1 P24864 2/20 0.46
CDK5 Q00535 2/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
MAPK10 P53779 1/20 0.44
LMNA P02545 1/20 0.41
AOC3 Q16853 2/20 0.40
ALDH1A1 P00352 4/20 0.40
RXFP1 Q9HBX9 1/20 0.40
PKM P14618 1/20 0.39
FDPS P14324 1/20 0.38
KDM4E B2RXH2 2/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL5835878 1.00 CDK2 (0.46) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5835804 0.83 CDK2 (0.52) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5835540 0.79 CDK2 (0.50) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5835873 0.76 CDK2 (0.50) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5835990 0.75 CDK2 (0.49) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5835971 0.75 CDK2 (0.49) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5836037 0.74 CCNE1 (0.54) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5835886 0.74 CDK2 (0.43) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL15581413 0.73 SMN1; SMN2 (0.51) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5835799 0.73 SMN1; SMN2 (0.51) CDK2CCNE1CDK5SMN1; SMN2MAPK10

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 3 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 disclosed
EP-1124810-A1 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA & UPJOHN S.p.A. (IT) 2001-08-22 EP disclosed
WO-2000026202-A1 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 2000-05-11 WO disclosed