SCHEMBL5469830

SCHEMBL5469830

Cc1n[nH]c2ccc(-c3cc(OC[C@H](Cc4ccccc4)NC(=O)OC(C)(C)C)cnc3-c3ccccc3)cc12

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 16/20 0.51
ROCK1 Q13464 8/20 0.48
CSNK1A1 P48729 1/20 0.43
CSNK1D P48730 1/20 0.43
CSNK1E P49674 1/20 0.43
MAPK14 Q16539 1/20 0.43
CDK2 P24941 2/20 0.42
CDK7 P50613 2/20 0.42
MAPK1 P28482 1/20 0.41
ATM Q13315 1/20 0.41
PRKACA P17612 1/20 0.38
PRKACG P22612 1/20 0.38
PRKACB P22694 1/20 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
SCHEMBL5472198 0.94 AKT1 (0.48) AKT1ROCK1CSNK1A1CSNK1DCSNK1E
SCHEMBL14430184 0.92 AKT1 (0.44) AKT1ROCK1CSNK1A1CSNK1DCSNK1E
SCHEMBL14430135 0.92 AKT1 (0.48) AKT1ROCK1CSNK1A1CSNK1DCSNK1E
SCHEMBL4660760 0.91 AKT1 (0.56) AKT1ROCK1CSNK1A1CSNK1DCSNK1E
SCHEMBL5467193 0.91 AKT1 (0.44) AKT1ROCK1CSNK1A1CSNK1DCSNK1E
SCHEMBL14430153 0.89 HDAC3 (0.52) AKT1ROCK1CDK2CDK7PRKACA
SCHEMBL14430179 0.89 AKT1 (0.42) AKT1ROCK1CSNK1A1CSNK1DCSNK1E
SCHEMBL6855907 0.86 HDAC3 (0.42) AKT1CDK2CDK7MAPK1ATM
SCHEMBL6855905 0.86 HDAC3 (0.42) AKT1CDK2CDK7MAPK1ATM
SCHEMBL4658726 0.86 AKT1 (0.44) AKT1ROCK1CSNK1A1CSNK1DCSNK1E

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-20070185152-A1 Inhibitors of akt activity SMITHKLINE BEECHAM CORPORATION 2007-08-09 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-20070185152-A1 Inhibitors of akt activity AKT1, AKT1S1, AKT2 AKT1 1/4885ROCK1 589/4885CSNK1A1 545/4885

“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.