SCHEMBL3352236

SCHEMBL3352236

COc1cc(N2CCN(C(=O)C(C)OC)CC2)ccc1Nc1ncc(Cl)c(-c2cnc3ccccn23)n1

nearest known ligand 0.88

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 20/20 0.88
KCNH2 Q12809 14/20 0.88
CDK2 P24941 3/20 0.82
INSR P06213 1/20 0.82

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
SCHEMBL3314850 1.00 IGF1R (0.88) IGF1RKCNH2CDK2INSR
SCHEMBL3312250 1.00 IGF1R (0.88) IGF1RKCNH2CDK2INSR
SCHEMBL3316405 0.94 IGF1R (1.00) IGF1RKCNH2CDK2INSR
SCHEMBL3313275 0.94 IGF1R (1.00) IGF1RKCNH2CDK2INSR
SCHEMBL3379335 0.94 IGF1R (1.00) IGF1RKCNH2CDK2INSR
SCHEMBL3317305 0.93 IGF1R (1.00) IGF1RKCNH2CDK2INSR
SCHEMBL3311211 0.93 IGF1R (1.00) IGF1RKCNH2CDK2INSR
SCHEMBL3319510 0.92 IGF1R (0.89) IGF1RKCNH2CDK2INSR
SCHEMBL3313863 0.91 IGF1R (1.00) IGF1RKCNH2CDK2INSR
SCHEMBL3315928 0.91 IGF1R (1.00) IGF1RKCNH2CDK2INSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010049731-A1 PYRAZOLO- AND IMIDAZOPYRIDINYLPYRIMIDINEAMINES AS IGF-1R TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2010-05-06 WO claimed