SCHEMBL5835873

SCHEMBL5835873

CCCC(=O)Nc1ncc(CCSC)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 3/20 0.50
CCNE1 P24864 2/20 0.50
CDK5 Q00535 2/20 0.50
SMN1; SMN2 Q16637 6/20 0.49
MAPK10 P53779 1/20 0.49
LMNA P02545 2/20 0.45
ALDH1A1 P00352 6/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 4/20 0.42
NPC1 O15118 3/20 0.42
FDPS P14324 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 2/20 0.42
KDM4E B2RXH2 2/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
AOC3 Q16853 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL5835804 0.83 CDK2 (0.52) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5835540 0.81 CDK2 (0.50) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5835971 0.80 CDK2 (0.49) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5835990 0.80 CDK2 (0.49) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5836037 0.79 CCNE1 (0.54) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL15581413 0.78 SMN1; SMN2 (0.51) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5835799 0.78 SMN1; SMN2 (0.51) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5835878 0.76 CDK2 (0.46) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5835874 0.76 CDK2 (0.46) CDK2CCNE1CDK5SMN1; SMN2MAPK10
SCHEMBL5837409 0.75 SMN1; SMN2 (0.58) SMN1; SMN2MAPK10ALDH1A1PKMRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 claimed
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 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
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
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