SCHEMBL5867928

SCHEMBL5867928

O=C(c1ccc(F)cc1)c1c[nH]c(C(=O)Nc2cc(C3CC3)[nH]n2)c1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 18/20 0.60
CDK2 P24941 18/20 0.60
CCNA1 P78396 18/20 0.60
HTT P42858 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL5867885 0.89 CCNA2 (0.60) CCNA2CDK2CCNA1
SCHEMBL5868051 0.86 CCNA2 (0.78) CCNA2CDK2CCNA1
SCHEMBL5867530 0.86 CDK2 (0.54) CCNA2CDK2CCNA1
SCHEMBL5867899 0.85 CCNA2 (0.60) CCNA2CDK2CCNA1
SCHEMBL5867965 0.82 CCNA2 (0.73) CCNA2CDK2CCNA1
SCHEMBL5867441 0.82 CCNA2 (0.60) CCNA2CDK2CCNA1
SCHEMBL5867857 0.81 CCNA2 (0.60) CCNA2CDK2CCNA1
SCHEMBL5867767 0.81 HTT (0.45) HTTL3MBTL1
SCHEMBL5868159 0.81 CCNA2 (0.60) CCNA2CDK2CCNA1
SCHEMBL5867427 0.81 CDK2 (0.57) CCNA2CDK2CCNA1

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 8 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
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