SCHEMBL5065045

SCHEMBL5065045

CC(C)(C)N(CCC(O)c1ccc(Cl)cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.43
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
UTS2R Q9UKP6 7/20 0.39
RIPK1 Q13546 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL5069200 0.86 RIPK1 (0.53) AOC3MEN1KMT2ARIPK1HTT
SCHEMBL1529441 0.86 RIPK1 (0.53) AOC3MEN1KMT2ARIPK1HTT
SCHEMBL5065804 0.86 RIPK1 (0.53) AOC3MEN1KMT2ARIPK1HTT
SCHEMBL15812308 0.85 AOC3 (0.53) AOC3MEN1KMT2A
SCHEMBL5069163 0.83 ADRB3 (0.41) MEN1KMT2A
SCHEMBL5065788 0.77 ADRB2 (0.48) AOC3MEN1KMT2AHTTL3MBTL1
SCHEMBL19399105 0.75 AOC3 (0.51) AOC3MEN1KMT2AUTS2RGAA
SCHEMBL1530072 0.75 CYP2C9 (0.41) AOC3MEN1KMT2A
SCHEMBL5454333 0.74 AOC3 (0.58) AOC3UTS2RL3MBTL1
SCHEMBL4688473 0.72 POLB (0.40) AOC3MEN1KMT2A

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-20080318947-A1 Inhibitors of Akt Activity HEERDING DIRK A 2008-12-25 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-20080318947-A1 Inhibitors of Akt Activity PI4KB, PIK3CA, AKT2 AOC3 4778/4885MEN1 3151/4885KMT2A 1852/4885

“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.