SCHEMBL5867758

SCHEMBL5867758

CCCC(=O)c1c[nH]c(C(=O)Nc2cc(C3CC3)[nH]n2)c1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 19/20 0.62
CDK2 P24941 19/20 0.62
CCNA1 P78396 19/20 0.62
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL5867997 0.94 CCNA2 (0.57) CCNA2CDK2CCNA1
SCHEMBL5867756 0.86 CCNA2 (0.55) CCNA2CDK2CCNA1ALDH1A1
SCHEMBL5868112 0.86 CCNA2 (0.55) CCNA2CDK2CCNA1
SCHEMBL5867459 0.82 CDK2 (0.65) CCNA2CDK2CCNA1ALDH1A1
SCHEMBL5867857 0.82 CCNA2 (0.60) CCNA2CDK2CCNA1
SCHEMBL5867530 0.81 CDK2 (0.54) CCNA2CDK2CCNA1ALDH1A1
SCHEMBL6188841 0.80 CCNA2 (0.58) CCNA2CDK2CCNA1ALDH1A1
SCHEMBL5867928 0.77 CCNA2 (0.60) CCNA2CDK2CCNA1
SCHEMBL5868159 0.77 CCNA2 (0.60) CCNA2CDK2CCNA1ALDH1A1
SCHEMBL5867441 0.77 CCNA2 (0.60) 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 5 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
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-1454091-A Immunostimulatory nucleic acids UNIV IOWA RES FOUND (US) 2003-11-05 CN 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