SCHEMBL3933286

SCHEMBL3933286

CNC(=O)C1CCCN1c1nc(Nc2cc(C3CC3)[nH]n2)n2cccc2n1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 20/20 0.54
CCNE2 O96020 7/20 0.54
CCNE1 P24864 7/20 0.54
CDK2 P24941 7/20 0.54

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
SCHEMBL1269899 1.00 IGF1R (0.54) IGF1RCCNE2CCNE1CDK2
SCHEMBL1269742 0.91 IGF1R (0.53) IGF1RCCNE2CCNE1CDK2
SCHEMBL1269235 0.90 IGF1R (0.60) IGF1RCCNE2CCNE1CDK2
SCHEMBL1270104 0.90 IGF1R (0.56) IGF1RCCNE2CCNE1CDK2
SCHEMBL1268963 0.90 IGF1R (0.56) IGF1RCCNE2CCNE1CDK2
SCHEMBL1269754 0.90 IGF1R (0.59) IGF1RCCNE2CCNE1CDK2
SCHEMBL1269100 0.89 IGF1R (0.66) IGF1RCCNE2CCNE1CDK2
SCHEMBL15810234 0.89 IGF1R (0.66) IGF1RCCNE2CCNE1CDK2
SCHEMBL1269483 0.89 IGF1R (0.66) IGF1RCCNE2CCNE1CDK2
SCHEMBL1269162 0.89 IGF1R (0.69) IGF1RCCNE2CCNE1CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2041138-A2 PYRROLOTRIAZINE KINASE INHIBITORS Brystol-Myers Squibb Company (US) 2009-04-01 EP claimed
WO-2008005956-A2 PYRROLOTRIAZINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-10 WO claimed
EP-2041138-A2 PYRROLOTRIAZINE KINASE INHIBITORS Brystol-Myers Squibb Company (US) 2009-04-01 EP disclosed
WO-2008005956-A2 PYRROLOTRIAZINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-10 WO disclosed