SCHEMBL2738784

SCHEMBL2738784

C[C@@H]1C[C@H](O)c2ncnc(N)c21

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 16/20 0.39
AKT2 P31751 16/20 0.39
AKT3 Q9Y243 16/20 0.39
AHCY P23526 2/20 0.35
PIK3CA P42336 1/20 0.34
PRKG1 Q13976 1/20 0.34
LIMK1 P53667 1/20 0.34

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
SCHEMBL12288914 1.00 AKT1 (0.39) AKT1AKT2AKT3AHCYPIK3CA
SCHEMBL12293385 1.00 AKT1 (0.39) AKT1AKT2AKT3AHCYPIK3CA
SCHEMBL12293042 1.00 AKT1 (0.39) AKT1AKT2AKT3AHCYPIK3CA
SCHEMBL12293083 1.00 AKT1 (0.39) AKT1AKT2AKT3AHCYPIK3CA
SCHEMBL17771686 0.80 AKT1 (0.37) AKT1AKT2AKT3PIK3CAPRKG1
SCHEMBL12323867 0.80 LIMK1 (0.35) AKT1AKT2AKT3AHCYLIMK1
SCHEMBL17771782 0.80 AKT1 (0.37) AKT1AKT2AKT3PIK3CAPRKG1
SCHEMBL17771781 0.80 AKT1 (0.37) AKT1AKT2AKT3PIK3CAPRKG1
SCHEMBL12323863 0.80 LIMK1 (0.35) AKT1AKT2AKT3AHCYLIMK1
SCHEMBL12323054 0.80 LIMK1 (0.35) AKT1AKT2AKT3AHCYLIMK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012135753-A1 COMBINATIONS OF AKT INHIBITOR COMPOUNDS AND ERLOTINIB, AND METHODS OF USE GENENTECH, INC. (US) 2012-10-04 WO disclosed
WO-2012135749-A2 BIOMARKERS FOR PREDICTING SENSITIVITY TO CANCER TREATMENTS GENENTECH, INC. (US) 2012-10-04 WO disclosed
WO-2012088254-A1 AUTOPHAGY INDUCER AND INHIBITOR COMBINATION THERAPY FOR THE TREATMENT OF NEOPLASMS GENENTECH, INC. (US) 2012-06-28 WO disclosed
WO-2012087336-A1 AUTOPHAGY INDUCER AND INHIBITOR COMBINATION THERAPY FOR THE TREATMENT OF NEOPLASMS GENENTECH, INC. (US) 2012-06-28 WO disclosed
EP-2402325-A2 Hydroxylated and methoxylated cyclopenta[d]pyrimidines as AKT protein kinase inhibitors Array Biopharma, Inc. (US) 2012-01-04 EP disclosed
EP-2399909-A1 Hydroxylated and methoxylated cyclopenta[d]pyrimidines as akt protein kinase inhibitors Array Biopharma, Inc. (US) 2011-12-28 EP disclosed
WO-2011130654-A1 FOX03A AS PREDICTIVE BIOMARKER FOR PI3K/AKT KINASE PATHWAY INHIBITOR EFFICACY GENENTECH, INC. (US) 2011-10-20 WO disclosed
EP-2049501-B1 HYDROXYLATED AND METHOXYLATED CYCLOPENTA [D] PYRIMIDINES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2011-09-14 EP disclosed
WO-2008006040-A1 HYDROXYLATED AND METHOXYLATED CYCLOPENTA [D] PYRIMIDINES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2008-01-10 WO disclosed