SCHEMBL3905271

SCHEMBL3905271

Cc1ccc(CNCC(O)C(Cc2ccccc2)NC(=O)O)cc1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 10/20 0.64
SLC6A11 P48066 1/20 0.64
BCHE P06276 11/20 0.60
BACE2 Q9Y5Z0 1/20 0.50

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
SCHEMBL3916485 1.00 BACE1 (0.64) BACE1SLC6A11BCHEBACE2
SCHEMBL3916486 1.00 BACE1 (0.64) BACE1SLC6A11BCHEBACE2
SCHEMBL7610027 0.93 BACE1 (0.71) BACE1SLC6A11BCHE
SCHEMBL7610032 0.93 BACE1 (0.71) BACE1SLC6A11BCHE
SCHEMBL7607356 0.88 BACE1 (0.62) BACE1SLC6A11BCHEBACE2
SCHEMBL7614224 0.88 BACE1 (0.62) BACE1SLC6A11BCHE
SCHEMBL7607362 0.88 BACE1 (0.62) BACE1SLC6A11BCHEBACE2
SCHEMBL7614214 0.88 BACE1 (0.62) BACE1SLC6A11BCHE
SCHEMBL5450473 0.88 BCHE (0.61) BACE1SLC6A11BCHE
SCHEMBL5450466 0.88 BCHE (0.61) BACE1SLC6A11BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2004502669-A 2004-01-29 JP claimed
EP-1353898-A2 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2003-10-22 EP claimed
WO-2002002512-A2 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-01-10 WO claimed
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 BACE1 26/4885SLC6A11 1121/4885BCHE 3/4885

“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.