SCHEMBL13560232

SCHEMBL13560232

COc1cc(-c2nc([C@H]3C[C@@H](O)C3)n3ncnc(N)c23)ccc1C(=O)c1ccccc1

nearest known ligand 0.83

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 19/20 0.83
CSNK2A2 P19784 1/20 0.49
CSNK2A1 P68400 1/20 0.49

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
SCHEMBL4364079 0.91 TNK2 (1.00) TNK2
SCHEMBL4353457 0.89 TNK2 (1.00) TNK2
SCHEMBL13618361 0.89 TNK2 (1.00) TNK2
SCHEMBL4353454 0.89 TNK2 (1.00) TNK2
SCHEMBL13626521 0.87 TNK2 (0.82) TNK2
SCHEMBL4364083 0.81 TNK2 (0.67) TNK2CSNK2A2CSNK2A1
SCHEMBL4362526 0.78 TNK2 (1.00) TNK2
SCHEMBL4353507 0.78 TNK2 (1.00) TNK2
SCHEMBL4368927 0.78 TNK2 (1.00) TNK2
SCHEMBL4368467 0.77 TNK2 (1.00) TNK2

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
EP-2283020-B1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI PHARM INC (US) 2012-10-31 EP disclosed