SCHEMBL12986973

SCHEMBL12986973

CNC(=O)c1cc(OC)c2nc(-c3ccc(C4(NC(=O)O)CCC4)cc3)c(-c3ccccc3)n2n1

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 20/20 0.79
AKT2 P31751 20/20 0.79

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
SCHEMBL12985971 0.91 AKT1 (0.79) AKT1AKT2
SCHEMBL12986277 0.91 AKT1 (0.70) AKT1AKT2
SCHEMBL15679371 0.90 AKT1 (0.72) AKT1AKT2
SCHEMBL12985903 0.89 AKT1 (0.71) AKT1AKT2
SCHEMBL12985935 0.89 AKT1 (0.71) AKT1AKT2
SCHEMBL12985953 0.88 AKT1 (0.63) AKT1AKT2
SCHEMBL12986166 0.88 AKT1 (1.00) AKT1AKT2
SCHEMBL12985638 0.86 AKT1 (0.72) AKT1AKT2
SCHEMBL12986061 0.86 AKT1 (0.73) AKT1AKT2
SCHEMBL17353379 0.85 AKT1 (0.79) AKT1AKT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9206185-B2 Imidazopyridazines as Akt kinase inhibitors BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-08 US disclosed
EP-2694510-B1 IMIDAZOPYRIDAZINES AS AKT KINASE INHIBITORS BAYER IP GMBH (DE) 2015-10-14 EP disclosed
EP-2694510-A1 IMIDAZOPYRIDAZINES AS AKT KINASE INHIBITORS Bayer Intellectual Property GmbH (DE) 2014-02-12 EP disclosed
WO-2012136776-A1 IMIDAZOPYRIDAZINES AS AKT KINASE INHIBITORS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-10-11 WO disclosed