SCHEMBL1350451

SCHEMBL1350451

CC(C)(C)N(C(=O)O)C1(c2ccc(-c3nc4ccnc(O)c4cc3-c3ccccc3)cc2)CCC1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 17/20 0.41
AKT2 P31751 8/20 0.39
AKT3 Q9Y243 2/20 0.39
FECH P22830 1/20 0.39
TACR3 P29371 1/20 0.35
SLC22A12 Q96S37 2/20 0.35

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
SCHEMBL1352537 0.92 AKT1 (0.41) AKT1AKT2AKT3FECH
SCHEMBL1351858 0.91 AKT1 (0.40) AKT1AKT2AKT3FECHTACR3
SCHEMBL1351794 0.90 AKT1 (0.40) AKT1AKT2AKT3FECH
SCHEMBL1352428 0.89 AKT1 (0.39) AKT1AKT2AKT3FECHTACR3
SCHEMBL4299454 0.89 AKT1 (0.38) AKT1AKT2AKT3FECH
SCHEMBL1351777 0.89 AKT1 (0.41) AKT1AKT2AKT3FECHTACR3
SCHEMBL1352553 0.87 DHODH (0.39) AKT1AKT2AKT3FECH
SCHEMBL2027954 0.87 AKT1 (0.39) AKT1AKT2AKT3FECH
SCHEMBL1352098 0.85 AKT1 (0.46) AKT1AKT2AKT3FECHSLC22A12
SCHEMBL1352355 0.85 AKT1 (0.38) AKT1AKT2AKT3FECH

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-20110288090-A1 Inhibitors of AKT Activity MERCK SHARP & DOHME CORP. 2011-11-24 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-20110288090-A1 Inhibitors of AKT Activity PIK3CD, PIK3CA, PIK3CG AKT1 9/4885AKT2 5/4885AKT3 10/4885

“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.