SCHEMBL7209310

SCHEMBL7209310

CC(C(=O)Nc1cc(C2CC2)n[nH]1)c1ccc(N2CCCC2=O)cc1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 20/20 0.72
CDK2 P24941 20/20 0.72
CCNA1 P78396 19/20 0.72
CCNB2 O95067 2/20 0.72
CCNE2 O96020 2/20 0.72
CDK1 P06493 2/20 0.72
CCNB1 P14635 2/20 0.72
CCNE1 P24864 2/20 0.72
CDK5 Q00535 2/20 0.72
CDK5R1 Q15078 2/20 0.72
CCNB3 Q8WWL7 2/20 0.72

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
SCHEMBL6790291 0.85 CCNA2 (0.71) CCNA2CDK2CCNA1CCNB2CCNE2
SCHEMBL6784144 0.85 CCNA2 (0.71) CCNA2CDK2CCNA1CCNB2CCNE2
SCHEMBL6788293 0.85 CCNA2 (0.71) CCNA2CDK2CCNA1CCNB2CCNE2
SCHEMBL6787929 0.83 CCNA2 (1.00) CCNA2CDK2CCNA1CCNB2CCNE2
SCHEMBL3927344 0.83 CCNA2 (1.00) CCNA2CDK2CCNA1CCNB2CCNE2
SCHEMBL1882254 0.83 CCNA2 (1.00) CCNA2CDK2CCNA1CCNB2CCNE2
SCHEMBL6789599 0.83 CCNA2 (0.66) CCNA2CDK2CCNA1CCNB2CCNE2
SCHEMBL6783831 0.83 CCNA2 (0.66) CCNA2CDK2CCNA1CCNB2CCNE2
SCHEMBL6789793 0.83 CCNA2 (0.66) CCNA2CDK2CCNA1CCNB2CCNE2
SCHEMBL6783807 0.83 CCNA2 (0.66) CCNA2CDK2CCNA1CCNB2CCNE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1345909-A1 PHENYLACETAMIDO-PYRAZOLE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS Pharmacia Italia S.p.A. (IT) 2003-09-24 EP disclosed
WO-2002048114-A1 PHENYLACETAMIDO- PYRAZOLE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA S.P.A. (IT) 2002-06-20 WO disclosed