SCHEMBL4666353

SCHEMBL4666353

CCCCS(=O)(=O)CC(N)C(=O)NC(Cc1cc(F)cc(F)c1)C(O)CNCc1cccc(C(F)(F)F)c1

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.68
CTSB P07858 18/20 0.68
BCHE P06276 1/20 0.54

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
SCHEMBL14348036 0.92 CTSB (0.80) BACE1CTSB
SCHEMBL14348037 0.92 CTSB (0.80) BACE1CTSB
Trifluoroacetic Acid SCHEMBL6703505 0.91 CTSB (0.74) BACE1CTSB
SCHEMBL4666312 0.88 CTSB (0.74) BACE1CTSB
SCHEMBL4668118 0.88 CTSB (0.86) BACE1CTSB
SCHEMBL4665086 0.87 BACE1 (0.65) BACE1CTSB
SCHEMBL4666401 0.84 BACE1 (0.59) BACE1
SCHEMBL14348119 0.83 CTSB (0.74) BACE1CTSB
SCHEMBL14347858 0.82 CTSB (0.84) BACE1CTSB
SCHEMBL14348136 0.82 CTSB (0.65) BACE1CTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1395551-B1 HYDROXY ALKYL AMINE DERIVATIVES AS BETA-SECRETASE INHIBITORS AND THEIR USE FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND SIMILAR DISEASES ELAN PHARM INC (US) 2008-05-21 EP disclosed
US-20070299263-A1 Hydroxy Alkyl Amines Elan Pharmaceuticals, Inc. and Pharmacia & Upjohn Company 2007-12-27 US disclosed
US-7144897-B2 Hydroxy alkyl amines Elan Oharmaceuticals, Inc. (US) 2006-12-05 US disclosed
US-20030166717-A1 Hydroxy alkyl amines FRESKOS JOHN (US) 2003-09-04 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 (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-20030166717-A1 Hydroxy alkyl amines PSEN1, MAOA, PSEN2 BACE1 47/4885CTSB 2908/4885BCHE 37/4885
US-20070299263-A1 Hydroxy Alkyl Amines MAOA, PSEN2, PSEN1 BACE1 67/4885CTSB 2593/4885BCHE 20/4885

“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.