SCHEMBL3352606

SCHEMBL3352606

COc1cc(N2CC[N]CC2)ccc1Nc1ncc(Cl)c(-c2cnn3ccccc23)n1

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 14/20 0.79
CDK2 P24941 1/20 0.79
EGFR P00533 9/20 0.58
KCNH2 Q12809 7/20 0.58
INSR P06213 3/20 0.56
ALK Q9UM73 1/20 0.55

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
SCHEMBL3313620 0.91 IGF1R (0.84) IGF1RCDK2EGFRKCNH2ALK
SCHEMBL3344728 0.91 IGF1R (0.83) IGF1RCDK2EGFRKCNH2INSR
SCHEMBL2351237 0.88 IGF1R (1.00) IGF1RCDK2EGFRKCNH2INSR
SCHEMBL2348174 0.88 IGF1R (0.77) IGF1RCDK2EGFRKCNH2INSR
SCHEMBL2345721 0.86 IGF1R (0.85) IGF1RCDK2EGFRKCNH2INSR
SCHEMBL2346737 0.86 IGF1R (0.75) IGF1RCDK2EGFRKCNH2INSR
SCHEMBL3378394 0.86 IGF1R (0.84) IGF1RCDK2EGFRKCNH2INSR
SCHEMBL2361496 0.86 IGF1R (0.84) IGF1RCDK2EGFRKCNH2INSR
SCHEMBL2346279 0.86 IGF1R (0.89) IGF1RCDK2EGFRKCNH2INSR
SCHEMBL2365358 0.86 IGF1R (0.84) IGF1RCDK2EGFRKCNH2INSR

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