SCHEMBL5065151

SCHEMBL5065151

C[C@@H]([C@H](O)c1ccccc1)N(C(=O)O)C(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 2/20 0.55
AOC3 Q16853 1/20 0.51
GAA P10253 1/20 0.50
SLC6A4 P31645 1/20 0.46
NPY5R Q15761 7/20 0.44
ADRA2A P08913 1/20 0.44
ADRA2C P18825 1/20 0.44
LMNA P02545 1/20 0.44
HIF1A Q16665 1/20 0.44
NPY2R P49146 1/20 0.43

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
SCHEMBL5065158 1.00 KDM4E (0.55) KDM4EALDH1A1AOC3GAASLC6A4
SCHEMBL14908702 1.00 KDM4E (0.55) KDM4EALDH1A1AOC3GAASLC6A4
SCHEMBL20492448 0.87 ALDH1A1 (0.40) KDM4EALDH1A1AOC3GAASLC6A4
SCHEMBL7647994 0.87 NPY5R (0.46) KDM4EALDH1A1AOC3GAASLC6A4
SCHEMBL20492498 0.85 ALOX5 (0.41) KDM4EALDH1A1AOC3GAASLC6A4
SCHEMBL14909184 0.85 KDM4E (0.39) KDM4EALDH1A1AOC3GAA
SCHEMBL837657 0.85 ACP3 (0.40) KDM4EALDH1A1AOC3GAANPY5R
SCHEMBL835711 0.84 UGT2B7 (0.49) AOC3SLC6A4HIF1A
SCHEMBL19459927 0.83 GAA (0.44) KDM4EALDH1A1AOC3GAASLC6A4
SCHEMBL19517259 0.83 GAA (0.44) KDM4EALDH1A1AOC3GAASLC6A4

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 KDM4E 2078/4885ALDH1A1 4166/4885AOC3 4778/4885

“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.