SCHEMBL4237899

SCHEMBL4237899

CSc1ncc2cc(-c3ccccc3)c(-c3ccc(Cn4cccc4-c4cccnc4)cc3)nc2n1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 20/20 0.61
AKT2 P31751 20/20 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
SCHEMBL3891072 0.76 AKT1 (0.60) AKT1AKT2
SCHEMBL3891901 0.74 AKT1 (1.00) AKT1AKT2
SCHEMBL3897323 0.73 AKT1 (0.79) AKT1AKT2
SCHEMBL3707264 0.73 AKT1 (0.58) AKT1AKT2
SCHEMBL3903351 0.73 AKT1 (0.65) AKT1AKT2
SCHEMBL13790596 0.71 AKT1 (0.63) AKT1AKT2
SCHEMBL3891081 0.71 AKT1 (0.87) AKT1AKT2
SCHEMBL2899272 0.71 AKT1 (1.00) AKT1AKT2
SCHEMBL3893836 0.70 AKT1 (1.00) AKT1AKT2
SCHEMBL2896614 0.70 AKT1 (0.60) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1784175-A4 INHIBITORS OF AKT ACTIVITY MERCK & CO INC (US) 2009-07-22 EP disclosed
EP-1784175-A2 INHIBITORS OF AKT ACTIVITY Merck & Co., Inc. (US) 2007-05-16 EP disclosed
WO-2006036395-A2 INHIBITORS OF AKT ACTIVITY MERCK & CO., INC. (US) 2006-04-06 WO disclosed