SCHEMBL3915324

SCHEMBL3915324

C[C@H](NCC(O)C(Cc1ccccc1)NC(=O)O)c1ccccc1

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BCHE P06276 3/20 0.71
BACE1 P56817 9/20 0.59
APAF1 O14727 1/20 0.52
SLC6A11 P48066 1/20 0.52

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
SCHEMBL5435440 1.00 BCHE (0.71) BCHEBACE1APAF1SLC6A11
SCHEMBL3903568 1.00 BCHE (0.71) BCHEBACE1APAF1SLC6A11
SCHEMBL5444846 1.00 BCHE (0.71) BCHEBACE1APAF1SLC6A11
SCHEMBL3905025 1.00 BCHE (0.71) BCHEBACE1APAF1SLC6A11
SCHEMBL5444850 1.00 BCHE (0.71) BCHEBACE1APAF1SLC6A11
SCHEMBL5435433 1.00 BCHE (0.71) BCHEBACE1APAF1SLC6A11
SCHEMBL3905032 1.00 BCHE (0.71) BCHEBACE1APAF1SLC6A11
SCHEMBL14637748 0.87 BCHE (0.53) BCHEBACE1SLC6A11
SCHEMBL14636685 0.87 BCHE (0.53) BCHEBACE1SLC6A11
SCHEMBL3491209 0.86 BCHE (0.64) BCHEBACE1SLC6A11

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-7498436-B2 Substituted hydroxyethylamines PHARMACIA & UPJOHN COMPANY LLC (US) 2009-03-03 US disclosed
US-20060106256-A1 Substituted hydroxyethylamines PHARMACIA & UPJOHN COMPANY 2006-05-18 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-20060106256-A1 Substituted hydroxyethylamines HNMT, PNMT, BCHE BCHE 3/4885BACE1 26/4885APAF1 3273/4885

“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.