SCHEMBL6424448

SCHEMBL6424448

Cn1cc(C2=C(c3cn(P(=O)(O)O)c4ccccc34)C(=O)NC2=O)c2ccc([N+](=O)[O-])cc21

nearest known ligand 0.79

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCNE2 O96020 1/20 0.54
CDK4 P11802 1/20 0.54
CCND1 P24385 1/20 0.54
CCNE1 P24864 1/20 0.54
CDK2 P24941 1/20 0.54
PRKCA P17252 1/20 0.50
GSK3B P49841 1/20 0.50

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
Enmd-981693 SCHEMBL608128 0.89 CCNE2 (0.69) CCNE2CDK4CCND1CCNE1CDK2
Enmd-981693 SCHEMBL29350364 0.89 CCNE2 (0.69) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL7653041 0.88 GSK3B (0.46) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL668748 0.85 CCNE2 (0.57) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL7651446 0.84 CCNE2 (0.47) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL6440413 0.84 CCNE2 (0.58) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL6425996 0.83 CCNE2 (0.55) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL6427037 0.83 CCNE2 (0.57) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL6425702 0.82 CCNE2 (0.54) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL7990320 0.82 PRKCA (0.43) CCNE2CDK4CCND1CCNE1CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1242408-A1 SUBSTITUTED BISINDOLYLMALEIMIDES FOR THE INHIBITION OF CELL PROLIFERATION F. HOFFMANN-LA ROCHE AG (CH) 2002-09-25 EP claimed
US-6313143-B1 USEFUL IN THERAPY OF CELL PROLIFERATIVE DISORDERS SUCH AS CANCER HOFFMANN-LA ROCHE INC. 2001-11-06 US claimed
WO-2001044234-A1 SUBSTITUTED BISINDOLYLMALEIMIDES FOR THE INHIBITION OF CELL PROLIFERATION F. HOFFMANN-LA ROCHE AG (CH) 2001-06-21 WO claimed
EP-1242408-B1 SUBSTITUTED BISINDOLYLMALEIMIDES FOR THE INHIBITION OF CELL PROLIFERATION HOFFMANN LA ROCHE (CH) 2005-10-12 EP disclosed
EP-1242408-A1 SUBSTITUTED BISINDOLYLMALEIMIDES FOR THE INHIBITION OF CELL PROLIFERATION F. HOFFMANN-LA ROCHE AG (CH) 2002-09-25 EP disclosed
US-6313143-B1 USEFUL IN THERAPY OF CELL PROLIFERATIVE DISORDERS SUCH AS CANCER HOFFMANN-LA ROCHE INC. 2001-11-06 US disclosed
WO-2001044234-A1 SUBSTITUTED BISINDOLYLMALEIMIDES FOR THE INHIBITION OF CELL PROLIFERATION F. HOFFMANN-LA ROCHE AG (CH) 2001-06-21 WO disclosed