SCHEMBL5867694

SCHEMBL5867694

CC(=O)Nc1ccc(CC(=O)Nc2cc(C3CC3)[nH]n2)cc1

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 20/20 0.72
▸ CCNA2 P20248 13/20 0.72
▸ CCNA1 P78396 13/20 0.72
▸ CDK5 Q00535 4/20 0.66
▸ CDK9 P50750 3/20 0.66
▸ CCNE1 P24864 3/20 0.65
▸ CDK5R1 Q15078 3/20 0.65
▸ CCNB2 O95067 1/20 0.65
▸ CCNE2 O96020 1/20 0.65
▸ CDK1 P06493 1/20 0.65
▸ CCNB1 P14635 1/20 0.65
▸ CCNB3 Q8WWL7 1/20 0.65
▸ CCNT1 O60563 1/20 0.56

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
SCHEMBL6390430 0.95 CDK2 (0.73) CDK2CCNA2CCNA1CDK5CDK9
SCHEMBL5867439 0.88 CDK2 (0.77) CDK2CCNA2CCNA1CDK5CDK9
SCHEMBL6191567 0.88 CDK2 (0.68) CDK2CCNA2CCNA1CDK5CDK9
SCHEMBL5867497 0.88 CDK2 (0.77) CDK2CCNA2CCNA1CDK5CDK9
SCHEMBL6192488 0.87 CDK2 (0.72) CDK2CCNA2CCNA1CDK5CDK9
SCHEMBL5867693 0.87 CDK2 (0.71) CDK2CCNA2CCNA1CDK5CDK9
SCHEMBL5867845 0.85 CDK2 (0.79) CDK2CCNA2CCNA1CDK5CDK9
SCHEMBL5867523 0.85 CDK2 (0.68) CDK2CCNA2CCNA1CDK5CDK9
SCHEMBL5868284 0.84 CDK2 (0.78) CDK2CCNA2CCNA1CDK5CDK9
SCHEMBL5867807 0.84 CDK2 (0.77) CDK2CCNA2CCNA1CDK5CDK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1202733-B1 3(5)-AMINO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-10-05 — — EP claimed
EP-1202733-A4 3(5)-AMINO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2003-05-14 — — EP claimed
JP-2003507329-A — — 2003-02-25 — — JP claimed
EP-1202733-A1 3(5)-AMINO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS Pharmacia Italia S.p.A. (IT) 2002-05-08 — — EP claimed
WO-2001012189-A1 3(5)-AMINO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA S.P.A. (IT) 2001-02-22 — — WO claimed
US-7034049-B1 3(5)-amino-pyrazole derivatives, process for their preparation and their use as antitumor agents PHARMACIA ITALIA S.P.A. (IT) 2006-04-25 — — US disclosed
EP-1202733-B1 3(5)-AMINO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-10-05 — — EP disclosed
EP-1202733-A4 3(5)-AMINO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2003-05-14 — — EP disclosed
CN-1373662-A 3(5)-amino-pyrazole derivs., process for their preparation and their use as antitumor agents PHARMACIA & UP JOHN S P A (IT) 2002-10-09 — — CN disclosed
EP-1202733-A1 3(5)-AMINO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS Pharmacia Italia S.p.A. (IT) 2002-05-08 — — EP disclosed
WO-2001012189-A1 3(5)-AMINO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA S.P.A. (IT) 2001-02-22 — — WO disclosed
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