SCHEMBL5313007

SCHEMBL5313007

Cc1cc(-c2ccccn2)nc2cc(-c3nc(C4CCC4)n4ccncc34)ccc12

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.45
CYP3A4 P08684 1/20 0.45
BTK Q06187 9/20 0.44
TNK2 Q07912 10/20 0.41

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
SCHEMBL5139317 0.88 IGF1R (0.51) IGF1RCYP3A4BTKTNK2
SCHEMBL400491 0.83 IGF1R (0.66) IGF1RCYP3A4TNK2
SCHEMBL5139332 0.79 IGF1R (0.57) IGF1RCYP3A4TNK2
Carbamic Acid SCHEMBL4060715 0.78 IGF1R (0.61) IGF1RCYP3A4TNK2
SCHEMBL5083975 0.76 IGF1R (0.43) IGF1RCYP3A4BTK
SCHEMBL5086159 0.76 TNK2 (0.35) IGF1RCYP3A4TNK2
SCHEMBL10225365 0.75 IGF1R (0.64) IGF1RCYP3A4TNK2
SCHEMBL400649 0.75 IGF1R (0.69) IGF1RCYP3A4BTKTNK2
SCHEMBL5082381 0.75 IGF1R (0.47) IGF1RCYP3A4BTKTNK2
SCHEMBL399410 0.74 IGF1R (0.70) IGF1RCYP3A4TNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1740591-A1 6,6-BICYCLIC RING SUBSTITUTED HETEROBICYCLIC PROTEIN KINASE INHIBITORS OSI Pharmaceuticals, Inc. (US) 2007-01-10 EP disclosed
WO-2005097800-A1 6,6-BICYCLIC RING SUBSTITUTED HETEROBICYCLIC PROTEIN KINASE INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2005-10-20 WO disclosed