SCHEMBL924178

SCHEMBL924178

CCc1ccc2c(c1)[C@@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)C1CNc3ccccc3O1)CCO2

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 18/20 0.51
CTSD P07339 15/20 0.51
BACE2 Q9Y5Z0 1/20 0.45
HPGD P15428 1/20 0.42

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
SCHEMBL924183 1.00 BACE1 (0.51) BACE1CTSDBACE2HPGD
SCHEMBL924181 1.00 BACE1 (0.51) BACE1CTSDBACE2HPGD
SCHEMBL2607309 0.85 BACE1 (0.74) BACE1CTSDBACE2
SCHEMBL2607261 0.85 BACE1 (0.71) BACE1CTSDBACE2
SCHEMBL2607059 0.79 BACE1 (0.68) BACE1CTSDBACE2
SCHEMBL2607257 0.78 BACE1 (0.67) BACE1CTSDBACE2
SCHEMBL3167770 0.77 BACE1 (0.72) BACE1CTSDBACE2
SCHEMBL3167755 0.77 BACE1 (0.72) BACE1CTSDBACE2
SCHEMBL13315909 0.76 BACE1 (0.81) BACE1CTSDBACE2
SCHEMBL14450737 0.76 BACE1 (0.81) BACE1CTSDBACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163766-B2 Beta-secretase modulators and methods of use AMGEN INC. (US) 2012-04-24 US disclosed
US-20110118250-A1 BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2011-05-19 US disclosed
US-7872009-B2 Beta-Secretase modulators and methods of use AMGEN INC. (US) 2011-01-18 US disclosed
EP-1954693-A1 BETA-SECRETASE MODULATORS AND METHODS OF USE Amgen Inc. (US) 2008-08-13 EP disclosed
US-20070185103-A1 Beta-secretase modulators and methods of use AMGEN INC. 2007-08-09 US disclosed
WO-2007062007-A1 BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2007-05-31 WO 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 (2 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-20110118250-A1 BETA-SECRETASE MODULATORS AND METHODS OF USE BACE1, BACE2, APP BACE1 1/4885CTSD 152/4885BACE2 2/4885
US-20070185103-A1 Beta-secretase modulators and methods of use BACE1, BACE2, APP BACE1 1/4885CTSD 152/4885BACE2 2/4885

“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.