SCHEMBL4068532

SCHEMBL4068532

CNC(=O)O.Nc1nccn2c(C3CCCCC3)nc(-c3ccc4ccc(Oc5ccccc5)nc4c3)c12

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 18/20 0.65
IGF1R P08069 2/20 0.61
CYP3A4 P08684 1/20 0.61

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
Carbamic Acid SCHEMBL4063655 0.94 TNK2 (0.69) TNK2IGF1RCYP3A4
SCHEMBL400061 0.90 TNK2 (0.74) TNK2IGF1RCYP3A4
SCHEMBL397651 0.90 TNK2 (0.78) TNK2IGF1RCYP3A4
SCHEMBL13504908 0.88 TNK2 (0.84) TNK2
SCHEMBL28811350 0.88 TNK2 (0.78) TNK2IGF1RCYP3A4
SCHEMBL4064161 0.87 IGF1R (0.81) TNK2IGF1RCYP3A4
SCHEMBL400088 0.87 TNK2 (0.77) TNK2IGF1RCYP3A4
SCHEMBL4066034 0.86 IGF1R (0.61) TNK2IGF1R
Carbamic Acid SCHEMBL4069846 0.85 TNK2 (0.67) TNK2
SCHEMBL400084 0.85 TNK2 (0.75) TNK2IGF1RCYP3A4

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-2168968-B1 6,6-bicyclic ring substituted heterobicyclic protein kinase inhibitors OSI PHARMACEUTICALS LLC (US) 2017-08-23 EP claimed
EP-1740591-B1 6,6-BICYCLIC RING SUBSTITUTED HETEROBICYCLIC PROTEIN KINASE INHIBITORS OSI PHARM INC (US) 2009-06-17 EP claimed