SCHEMBL6344818

SCHEMBL6344818

O=C[C@H](Cc1cc(F)cc(F)c1)NC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 9/20 0.40
CTSB P07858 3/20 0.37
ACE P12821 1/20 0.36
GSK3B P49841 1/20 0.35
BACE1 P56817 1/20 0.35

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
SCHEMBL18989435 0.87 RXRA (0.40) CAPN1BACE1
SCHEMBL6244228 0.84 SLC1A1 (0.50) CAPN1CTSB
SCHEMBL25382819 0.83 CAPN1 (0.47) CAPN1CTSBACE
SCHEMBL3989376 0.83 CAPN1 (0.47) CAPN1CTSBACE
SCHEMBL18989366 0.80 TACR1 (0.42) CAPN1
SCHEMBL3216189 0.78 CTSK (0.51) CTSBACEBACE1
SCHEMBL3221648 0.78 CTSK (0.51) CTSBACEBACE1
SCHEMBL5859417 0.78 CTSB (0.54) CTSB
SCHEMBL5929919 0.78 CTSB (0.54) CTSB
SCHEMBL2369340 0.77 CAPN1 (0.61) CAPN1CTSBACE

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-6906104-B2 Aminediols for the treatment of Alzheimer's disease PHARMACIA & UPJOHN COMPANY (US) 2005-06-14 US disclosed
US-20030092747-A1 Aminediols for the treatment of Alzheimer's disease PHARMACIA & UPJOHN COMPANY 2003-05-15 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-20030092747-A1 Aminediols for the treatment of Alzheimer's disease BACE1, APP, BACE2 CAPN1 1974/4885CTSB 325/4885ACE 120/4885

“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.