SCHEMBL6173475

SCHEMBL6173475

CC(=O)Nc1nc(N)c(C(C)C)s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 1/20 0.44
PIK3CG P48736 2/20 0.43
PIK3CD O00329 1/20 0.43
PIK3CA P42336 1/20 0.43
PIK3CB P42338 1/20 0.43
DYRK1A Q13627 7/20 0.41
ADORA1 P30542 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 1/20 0.39
CA12 O43570 1/20 0.39
CA11 O75493 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA3 P07451 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL12894237 0.81 PIK3CG (0.54) PIK3CGPIK3CDPIK3CAPIK3CBDYRK1A
SCHEMBL24624393 0.79 PIK3CD (0.46) CLK1PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL25865065 0.79 DYRK1A (0.44) PIK3CGPIK3CDPIK3CAPIK3CBDYRK1A
SCHEMBL1841799 0.78 L3MBTL1 (0.46) CLK1PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL25865064 0.77 ALDH1A1 (0.43) PIK3CGPIK3CDPIK3CAPIK3CBDYRK1A
SCHEMBL25865063 0.77 ALDH1A1 (0.43) PIK3CGPIK3CDPIK3CAPIK3CBDYRK1A
SCHEMBL1845956 0.76 PIK3CA (0.45) PIK3CGPIK3CDPIK3CAPIK3CBDYRK1A
SCHEMBL25865060 0.76 DYRK1A (0.45) PIK3CGPIK3CDPIK3CAPIK3CBDYRK1A
SCHEMBL14288340 0.74 PIK3CG (0.47) PIK3CGPIK3CDPIK3CAPIK3CBDYRK1A
SCHEMBL27459155 0.71 DYRK1A (0.43) PIK3CGPIK3CDPIK3CAPIK3CBDYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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