SCHEMBL2300083

SCHEMBL2300083

Cn1ncc(Cl)c1-c1cc(NC(=O)[C@H](Cc2ccc(F)c(F)c2)CN(Cc2ccccc2)C(=O)O)sc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 13/20 0.46
AKT2 P31751 5/20 0.46
AKT3 Q9Y243 5/20 0.46
PRKCB P05771 4/20 0.46
PRKCA P17252 4/20 0.46
ROCK1 Q13464 4/20 0.46
ROCK2 O75116 2/20 0.46
PRKACA P17612 2/20 0.46
PRKACB P22694 2/20 0.46
PKN1 Q16512 2/20 0.46
PRKD2 Q9BZL6 2/20 0.46
CIT O14578 1/20 0.46
SGK1 O00141 3/20 0.45
PRKD3 O94806 3/20 0.45
PRKCG P05129 3/20 0.45
RPS6KB1 P23443 3/20 0.45
PRKCH P24723 3/20 0.45
PRKCI P41743 3/20 0.45
PRKCE Q02156 3/20 0.45
PRKCQ Q04759 3/20 0.45

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
SCHEMBL2300080 1.00 AKT1 (0.46) AKT1AKT2AKT3PRKCBPRKCA
SCHEMBL2302214 0.86 AKT1 (0.55) AKT1AKT2AKT3PRKCBPRKCA
SCHEMBL12385393 0.86 AKT1 (0.55) AKT1AKT2AKT3PRKCBPRKCA
SCHEMBL2299884 0.86 AKT1 (0.55) AKT1AKT2AKT3PRKCBPRKCA
SCHEMBL3125109 0.85 AKT1 (0.47) AKT1AKT2AKT3PRKCBPRKCA
SCHEMBL3125113 0.85 AKT1 (0.47) AKT1AKT2AKT3PRKCBPRKCA
SCHEMBL12385390 0.84 AKT1 (0.44) AKT1AKT2AKT3PRKCBPRKCA
SCHEMBL12424921 0.84 AKT1 (0.44) AKT1AKT2AKT3PRKCBPRKCA
SCHEMBL2304468 0.83 AKT1 (0.44) AKT1AKT2AKT3PRKCBPRKCA
SCHEMBL2302178 0.80 AKT1 (0.56) AKT1AKT2AKT3PRKCBPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110196009-A1 INHIBITORS OF Akt ACTIVITY SMITHKLINE BEECHAM CORPORATION 2011-08-11 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-20110196009-A1 INHIBITORS OF Akt ACTIVITY AKT2, AKT1, AKT3 AKT1 2/4885AKT2 1/4885AKT3 3/4885

“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.