SCHEMBL5066327

SCHEMBL5066327

CCn1c(-c2nonc2N)nc2c(-c3ccccc3)ncc(CN(C)C3CCN(C)CC3)c21

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RPS6KA5 O75582 11/20 0.55
AKT1 P31749 6/20 0.55
RPS6KA1 Q15418 4/20 0.55
ROCK1 Q13464 7/20 0.45
SLC2A1 P11166 2/20 0.41
MAP4K4 O95819 1/20 0.40
PRKACA P17612 1/20 0.40
RPS6KB1 P23443 1/20 0.40
GSK3B P49841 1/20 0.40

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
SCHEMBL4068446 0.83 RPS6KA5 (0.53) RPS6KA5AKT1RPS6KA1ROCK1SLC2A1
SCHEMBL4064963 0.83 RPS6KA5 (0.55) RPS6KA5AKT1RPS6KA1ROCK1SLC2A1
SCHEMBL4065881 0.83 RPS6KA5 (0.60) RPS6KA5AKT1RPS6KA1ROCK1PRKACA
SCHEMBL5062967 0.82 RPS6KA5 (0.67) RPS6KA5AKT1RPS6KA1ROCK1SLC2A1
SCHEMBL4566808 0.80 RPS6KA5 (0.67) RPS6KA5AKT1RPS6KA1ROCK1PRKACA
SCHEMBL4240141 0.79 RPS6KA5 (0.59) RPS6KA5AKT1RPS6KA1ROCK1SLC2A1
Trifluoroacetic Acid SCHEMBL5058554 0.78 SLC2A1 (0.52) RPS6KA5AKT1RPS6KA1ROCK1SLC2A1
SCHEMBL5058506 0.77 RPS6KA5 (0.65) RPS6KA5AKT1RPS6KA1ROCK1PRKACA
Trifluoroacetic Acid SCHEMBL4389888 0.77 AKT1 (0.53) RPS6KA5AKT1RPS6KA1ROCK1SLC2A1
SCHEMBL4066679 0.77 RPS6KA5 (0.55) RPS6KA5AKT1RPS6KA1ROCK1SLC2A1

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-20080255143-A1 Inhibitors of Akt Activity SMITHKLINE BEECHAM CORPORATION (PA) 2008-10-16 US claimed
US-20080255143-A1 Inhibitors of Akt Activity SMITHKLINE BEECHAM CORPORATION (PA) 2008-10-16 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-20080255143-A1 Inhibitors of Akt Activity PI4KB, PIK3CA, AKT2 RPS6KA5 156/4885AKT1 5/4885RPS6KA1 127/4885

“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.