SCHEMBL3345458

SCHEMBL3345458

COc1cc(N2CC[N]CC2)ccc1Nc1ncc(F)c(-c2cnc3ccccn23)n1

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 20/20 0.79
CDK2 P24941 7/20 0.79
KCNH2 Q12809 10/20 0.68
INSR P06213 1/20 0.65

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
SCHEMBL3314795 0.93 IGF1R (0.81) IGF1RCDK2KCNH2INSR
SCHEMBL3313587 0.92 IGF1R (0.81) IGF1RCDK2KCNH2INSR
SCHEMBL3317743 0.91 IGF1R (0.82) IGF1RCDK2KCNH2INSR
SCHEMBL3313546 0.91 IGF1R (0.82) IGF1RCDK2KCNH2INSR
SCHEMBL3313237 0.90 IGF1R (0.79) IGF1RCDK2KCNH2INSR
SCHEMBL3345396 0.90 IGF1R (0.79) IGF1RCDK2KCNH2INSR
SCHEMBL3315830 0.90 IGF1R (0.78) IGF1RCDK2KCNH2INSR
SCHEMBL3319201 0.88 IGF1R (0.78) IGF1RCDK2KCNH2INSR
SCHEMBL3312532 0.88 IGF1R (1.00) IGF1RCDK2KCNH2INSR
SCHEMBL3314038 0.88 IGF1R (0.75) IGF1RCDK2KCNH2INSR

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