SCHEMBL17029641

SCHEMBL17029641

CC1C[C@H](O)c2ncnc(N3CCN(C(=O)[C@H](CN)c4ccc(Cl)c(Cl)c4)CC3)c21

nearest known ligand 0.82

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 20/20 0.82
AKT2 P31751 19/20 0.82
AKT3 Q9Y243 19/20 0.82
PIK3CA P42336 1/20 0.64
PRKG1 Q13976 1/20 0.64

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
SCHEMBL192506 1.00 AKT1 (0.82) AKT1AKT2AKT3PIK3CAPRKG1
SCHEMBL192507 1.00 AKT1 (0.82) AKT1AKT2AKT3PIK3CAPRKG1
SCHEMBL190693 1.00 AKT1 (0.82) AKT1AKT2AKT3PIK3CAPRKG1
SCHEMBL29822338 1.00 AKT1 (0.82) AKT1AKT2AKT3PIK3CAPRKG1
SCHEMBL190692 1.00 AKT1 (0.82) AKT1AKT2AKT3PIK3CAPRKG1
SCHEMBL191274 0.92 AKT1 (0.80) AKT1AKT2AKT3PIK3CAPRKG1
SCHEMBL2367077 0.92 AKT1 (0.80) AKT1AKT2AKT3PIK3CAPRKG1
SCHEMBL29822567 0.92 AKT1 (0.80) AKT1AKT2AKT3PIK3CAPRKG1
SCHEMBL192224 0.92 AKT1 (0.80) AKT1AKT2AKT3PIK3CAPRKG1
SCHEMBL29822431 0.92 AKT1 (0.80) AKT1AKT2AKT3PIK3CAPRKG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2399909-B1 Hydroxylated cyclopenta[d]pyrimidines as AKT protein kinase inhibitors ARRAY BIOPHARMA INC (US) 2015-08-26 EP disclosed
EP-2402325-B1 Hydroxylated cyclopenta[d]pyrimidines as AKT protein kinase inhibitors ARRAY BIOPHARMA INC (US) 2015-08-26 EP disclosed