SCHEMBL5867530

SCHEMBL5867530

O=C(Cc1ccc(F)cc1)c1c[nH]c(C(=O)Nc2cc(C3CC3)[nH]n2)c1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 19/20 0.54
CCNA2 P20248 16/20 0.54
CCNA1 P78396 16/20 0.54
CCNE1 P24864 3/20 0.49
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
GSK3B P49841 1/20 0.47

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
SCHEMBL5867459 0.90 CDK2 (0.65) CDK2CCNA2CCNA1CCNE1ALDH1A1
SCHEMBL5867928 0.86 CCNA2 (0.60) CDK2CCNA2CCNA1
SCHEMBL5868051 0.81 CCNA2 (0.78) CDK2CCNA2CCNA1
SCHEMBL5867758 0.81 CCNA2 (0.62) CDK2CCNA2CCNA1ALDH1A1
SCHEMBL5867616 0.80 CDK2 (0.77) CDK2CCNA2CCNA1CCNE1GSK3B
SCHEMBL5867756 0.80 CCNA2 (0.55) CDK2CCNA2CCNA1ALDH1A1
SCHEMBL5868112 0.80 CCNA2 (0.55) CDK2CCNA2CCNA1
SCHEMBL5867885 0.79 CCNA2 (0.60) CDK2CCNA2CCNA1
SCHEMBL5867997 0.79 CCNA2 (0.57) CDK2CCNA2CCNA1
SCHEMBL5867857 0.78 CCNA2 (0.60) CDK2CCNA2CCNA1LMNA

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 10 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
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