SCHEMBL2465732

SCHEMBL2465732

Cc1ccc(NC(=O)Oc2cc(C(C)(C)C)nn2C)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1

nearest known ligand 0.78

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LCK P06239 20/20 0.78
LYN P07948 18/20 0.78
KDR P35968 18/20 0.78
SRC P12931 16/20 0.78
INSR P06213 14/20 0.78
HCK P08631 12/20 0.78

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
SCHEMBL2471113 0.87 LCK (1.00) LCKLYNKDRSRCINSR
SCHEMBL2466467 0.85 LCK (0.79) LCKLYNKDRSRCINSR
SCHEMBL2466932 0.80 LCK (0.53) LCKLYNKDRSRCINSR
SCHEMBL2468747 0.79 LCK (0.71) LCKLYNKDRSRCINSR
SCHEMBL2465773 0.79 LCK (1.00) LCKLYNKDRSRCINSR
SCHEMBL2465736 0.77 LCK (1.00) LCKLYNKDRSRCINSR
SCHEMBL2466908 0.77 LCK (1.00) LCKLYNKDRSRCINSR
SCHEMBL2465102 0.76 LCK (0.74) LCKLYNKDRSRCINSR
SCHEMBL2465425 0.76 LCK (0.80) LCKLYNKDRSRCINSR
SCHEMBL2465599 0.76 LCK (1.00) LCKLYNKDRSRCINSR

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-1899329-B1 PYRIMIDINE-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2011-10-05 EP claimed