SCHEMBL1662453

SCHEMBL1662453

CCc1cn(CCO)c(C2CCN(c3ncnc4c3CN(CC(F)(F)F)C(=O)N4)CC2)n1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RPS6KB1 P23443 15/20 0.47
AKT1 P31749 15/20 0.47
RPS6KA1 Q15418 6/20 0.47
PRKCB P05771 4/20 0.47
ENPP1 P22413 3/20 0.38

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
SCHEMBL9893926 0.90 RPS6KB1 (0.58) RPS6KB1AKT1RPS6KA1PRKCB
SCHEMBL16457539 0.88 RPS6KB1 (0.43) RPS6KB1AKT1RPS6KA1PRKCBENPP1
SCHEMBL9894147 0.79 RPS6KB1 (0.53) RPS6KB1AKT1RPS6KA1PRKCB
SCHEMBL16457098 0.79 AKT1 (0.58) RPS6KB1AKT1RPS6KA1PRKCB
SCHEMBL16457100 0.79 AKT1 (0.58) RPS6KB1AKT1RPS6KA1PRKCB
SCHEMBL9894041 0.79 RPS6KB1 (0.55) RPS6KB1AKT1RPS6KA1PRKCB
SCHEMBL16457139 0.76 AKT1 (0.65) RPS6KB1AKT1RPS6KA1PRKCB
SCHEMBL16457141 0.76 AKT1 (0.65) RPS6KB1AKT1RPS6KA1PRKCB
SCHEMBL16457294 0.74 AKT1 (0.70) RPS6KB1AKT1RPS6KA1PRKCB
SCHEMBL16457297 0.74 AKT1 (0.70) RPS6KB1AKT1RPS6KA1PRKCB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2491032-B1 AKT INHIBITORS LILLY CO ELI (US) 2014-04-16 EP disclosed
EP-2491032-B1 AKT INHIBITORS LILLY CO ELI (US) 2014-04-16 EP disclosed
US-8436002-B2 AKT inhibitors ELI LILLY AND COMPANY (US) 2013-05-07 US disclosed
US-8436002-B2 AKT inhibitors ELI LILLY AND COMPANY (US) 2013-05-07 US disclosed
EP-2491032-A1 AKT INHIBITORS Eli Lilly and Company (US) 2012-08-29 EP disclosed
US-20120149684-A1 AKT INHIBITORS ELI LILLY AND COMPANY (US) 2012-06-14 US disclosed
US-20120149684-A1 AKT INHIBITORS ELI LILLY AND COMPANY (US) 2012-06-14 US disclosed
US-20120149684-A1 AKT INHIBITORS ELI LILLY AND COMPANY (US) 2012-06-14 US disclosed
WO-2011050016-A1 AKT INHIBITORS ELI LILLY AND COMPANY (US) 2011-04-28 WO disclosed
WO-2011050016-A1 AKT INHIBITORS ELI LILLY AND COMPANY (US) 2011-04-28 WO 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-20120149684-A1 AKT INHIBITORS AKT2, PIK3CA, AKT3 RPS6KB1 41/4885AKT1 4/4885RPS6KA1 47/4885

“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.