SCHEMBL5404737

SCHEMBL5404737

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

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 5/20 0.58
PSEN2 P49810 5/20 0.58
APH1B Q8WW43 5/20 0.58
NCSTN Q92542 5/20 0.58
APH1A Q96BI3 5/20 0.58
PSENEN Q9NZ42 5/20 0.58
KLK5 Q9Y337 3/20 0.58
APP P05067 1/20 0.57
REN P00797 4/20 0.51
ATM Q13315 1/20 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
SCHEMBL5404739 1.00 PSEN1 (0.58) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5387761 0.90 KLK5 (0.59) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5387766 0.90 KLK5 (0.59) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5223341 0.86 KLK5 (0.62) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5217566 0.86 KLK5 (0.62) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5217575 0.86 KLK5 (0.62) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5223349 0.86 KLK5 (0.62) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL30318975 0.85 BCHE (0.61) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10722184 0.85 BCHE (0.61) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1104912 0.85 KLK5 (0.61) PSEN1PSEN2APH1BNCSTNAPH1A

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 2 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
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 PSEN1 4/4885PSEN2 2/4885APH1B 23/4885

“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.