SCHEMBL4288171

SCHEMBL4288171

CCn1c(-c2nonc2N)nc2c(Cl)ncc(OC[C@@H](C)CBr)c21

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.57
RPS6KA5 O75582 9/20 0.53
AKT1 P31749 14/20 0.52
RPS6KA1 Q15418 12/20 0.52
ROCK1 Q13464 13/20 0.51
AKT2 P31751 4/20 0.49
AKT3 Q9Y243 1/20 0.48

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
SCHEMBL4295261 0.86 AKT1 (0.61) SLC2A1RPS6KA5AKT1RPS6KA1ROCK1
SCHEMBL4303867 0.85 SLC2A1 (0.53) SLC2A1RPS6KA5AKT1RPS6KA1ROCK1
SCHEMBL4301683 0.84 SLC2A1 (0.57) SLC2A1RPS6KA5AKT1RPS6KA1ROCK1
SCHEMBL4292488 0.84 SLC2A1 (0.59) SLC2A1RPS6KA5AKT1RPS6KA1ROCK1
SCHEMBL21350454 0.83 AKT1 (0.73) SLC2A1RPS6KA5AKT1RPS6KA1ROCK1
SCHEMBL4290330 0.83 SLC2A1 (0.58) SLC2A1RPS6KA5AKT1RPS6KA1ROCK1
SCHEMBL4298401 0.82 SLC2A1 (0.50) SLC2A1RPS6KA5AKT1RPS6KA1ROCK1
SCHEMBL4296943 0.81 SLC2A1 (0.57) SLC2A1RPS6KA5AKT1RPS6KA1ROCK1
SCHEMBL690731 0.80 RPS6KA5 (0.63) SLC2A1RPS6KA5AKT1RPS6KA1ROCK1
SCHEMBL4288391 0.79 SLC2A1 (0.70) SLC2A1RPS6KA5AKT1RPS6KA1ROCK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090227616-A1 INHIBITORS OF AKT ACTIVITY SMITHKLINE BEECHAM CORPORATION, A CORPORATION 2009-09-10 US disclosed
EP-1948185-A2 INHIBITORS OF AKT ACTIVITY SmithKline Beecham Corporation (US) 2008-07-30 EP disclosed
WO-2007058852-A2 INHIBITORS OF AKT ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2007-05-24 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-20090227616-A1 INHIBITORS OF AKT ACTIVITY PI4KB, PIK3CA, AKT2 SLC2A1 3039/4885RPS6KA5 156/4885AKT1 5/4885

“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.