SCHEMBL5065755

SCHEMBL5065755

CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)nc(OC(CCN)c3ccc(Cl)cc3)cc21

nearest known ligand 0.86

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 18/20 0.86
AKT2 P31751 18/20 0.86
GSK3B P49841 18/20 0.86
AKT3 Q9Y243 8/20 0.86

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
SCHEMBL4596235 0.94 AKT1 (0.86) AKT1AKT2GSK3BAKT3
SCHEMBL4596246 0.93 AKT1 (0.86) AKT1AKT2GSK3BAKT3
SCHEMBL4595913 0.93 AKT1 (1.00) AKT1AKT2GSK3BAKT3
SCHEMBL4596238 0.93 AKT1 (1.00) AKT1AKT2GSK3BAKT3
SCHEMBL4595709 0.93 AKT1 (1.00) AKT1AKT2GSK3BAKT3
SCHEMBL4595729 0.92 AKT1 (0.85) AKT1AKT2GSK3BAKT3
SCHEMBL4594855 0.90 AKT1 (0.79) AKT1AKT2GSK3BAKT3
SCHEMBL4594586 0.89 AKT1 (0.82) AKT1AKT2GSK3BAKT3
SCHEMBL4596263 0.89 AKT1 (0.86) AKT1AKT2GSK3BAKT3
SCHEMBL4596176 0.88 AKT1 (0.92) AKT1AKT2GSK3BAKT3

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
US-20080318947-A1 Inhibitors of Akt Activity HEERDING DIRK A 2008-12-25 US claimed
US-20080318947-A1 Inhibitors of Akt Activity HEERDING DIRK A 2008-12-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080318947-A1 Inhibitors of Akt Activity PI4KB, PIK3CA, AKT2 AKT1 5/4885AKT2 3/4885GSK3B 139/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.