SCHEMBL5835456

SCHEMBL5835456

COC(=O)c1ccc(C(=O)Nc2ncc(C(C)C)s2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 7/20 0.73
▸ CCNE1 P24864 6/20 0.73
▸ CDK5 Q00535 6/20 0.73
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ CCNT1 O60563 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ CDK1 P06493 1/20 0.51
▸ CDK4 P11802 1/20 0.51
▸ CCNB1 P14635 1/20 0.51
▸ CCNA2 P20248 1/20 0.51
▸ CCND1 P24385 1/20 0.51
▸ CDK7 P50613 1/20 0.51
▸ CDK9 P50750 1/20 0.51
▸ CCNH P51946 1/20 0.51
▸ MNAT1 P51948 1/20 0.51
▸ CDK5R1 Q15078 1/20 0.51
▸ CSNK2A2 P19784 4/20 0.50
▸ CSNK2A1 P68400 4/20 0.50
▸ FDPS P14324 1/20 0.48
▸ KDR P35968 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
SCHEMBL5835991 0.88 CCNE1 (0.71) CDK2CCNE1CDK5SMN1; SMN2CSNK2A2
SCHEMBL5835791 0.86 CDK2 (0.77) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL6176147 0.86 CDK2 (0.82) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL5835261 0.86 CDK2 (0.77) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL5836120 0.86 CDK2 (0.77) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL5836084 0.85 CDK2 (0.75) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL5835822 0.85 CDK2 (0.75) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL5835708 0.85 CDK2 (0.75) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL5835551 0.85 CDK2 (0.75) CDK2CCNE1CDK5SMN1; SMN2CCNT1
SCHEMBL5836102 0.85 CDK2 (1.00) 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 6 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
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
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