SCHEMBL5835633

SCHEMBL5835633

CC(C)c1cnc(NC(=O)c2ccc(-c3cc(C(F)(F)F)ccc3Cl)o2)s1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.65
MEN1 O00255 7/20 0.65
SMN1; SMN2 Q16637 5/20 0.59
HTT P42858 2/20 0.59
S1PR4 O95977 4/20 0.47
S1PR5 Q9H228 2/20 0.47
CCNE1 P24864 1/20 0.47
CDK2 P24941 1/20 0.47
CDK5 Q00535 1/20 0.47
ALDH1A1 P00352 7/20 0.46
MAPT P10636 6/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HPGD P15428 5/20 0.46
KDM4E B2RXH2 5/20 0.46
LMNA P02545 2/20 0.45
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43

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
SCHEMBL5835615 0.83 KMT2A (0.67) KMT2AMEN1SMN1; SMN2CCNE1CDK2
SCHEMBL5836800 0.77 KDM4E (0.60) KMT2AMEN1SMN1; SMN2CCNE1CDK2
SCHEMBL5836138 0.75 MEN1 (0.48) KMT2AMEN1SMN1; SMN2HTTS1PR4
SCHEMBL13044122 0.74 MEN1 (0.53) KMT2AMEN1SMN1; SMN2HTTS1PR4
SCHEMBL5836220 0.74 CDK2 (0.56) SMN1; SMN2CCNE1CDK2CDK5ALDH1A1
SCHEMBL5836744 0.73 CCNE1 (0.67) CCNE1CDK2CDK5MAPTNPSR1
SCHEMBL13078465 0.73 MEN1 (0.56) KMT2AMEN1SMN1; SMN2HTTS1PR4
SCHEMBL5835048 0.72 MEN1 (0.64) KMT2AMEN1SMN1; SMN2CCNE1CDK2
SCHEMBL5836959 0.72 MEN1 (0.50) KMT2AMEN1SMN1; SMN2CCNE1CDK2
SCHEMBL5835787 0.72 CCNE1 (0.59) KMT2ASMN1; SMN2CCNE1CDK2CDK5

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
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
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
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