SCHEMBL5220702

SCHEMBL5220702

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCC1CCCCC1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
REN P00797 11/20 0.58
KLK5 Q9Y337 3/20 0.56
ATM Q13315 2/20 0.51

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
SCHEMBL30318981 1.00 REN (0.58) RENKLK5ATM
SCHEMBL5386298 0.95 KLK5 (0.57) RENKLK5ATM
SCHEMBL5386289 0.95 KLK5 (0.57) RENKLK5ATM
SCHEMBL13618023 0.91 YAP1 (0.51) RENKLK5
SCHEMBL5400909 0.90 KLK5 (0.52) RENKLK5ATM
SCHEMBL5400906 0.90 KLK5 (0.52) RENKLK5ATM
SCHEMBL7309908 0.87 KLK5 (0.65) KLK5ATM
SCHEMBL14066009 0.87 KLK5 (0.55) RENKLK5ATM
SCHEMBL5222884 0.86 KLK5 (0.59) RENKLK5ATM
SCHEMBL5222893 0.86 KLK5 (0.59) RENKLK5ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7253198-B2 Hydroxyethylamine derivatives for the treatment of Alzheimer's disease GLAXO GROUP LIMITED (GB) 2007-08-07 US disclosed
EP-1567488-B1 HYDROXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE GLAXO GROUP LTD (GB) 2007-02-21 EP disclosed
US-20060025459-A1 Hydroxyethylamine derivatives for the treatment of alzheimer's disease GLAXO GROUP LIMITED (GB) 2006-02-02 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-20060025459-A1 Hydroxyethylamine derivatives for the treatment of alzheimer's disease BACE2, PSEN2, BACE1 REN 2941/4885KLK5 3361/4885ATM 870/4885

“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.