SCHEMBL6352164

SCHEMBL6352164

CCCN(CCC)C(=O)c1cc(C)cc(C(=O)NC(Cc2ccc(O)cc2)C(O)C(O)CCCC#N)c1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 18/20 0.51
CTSD P07339 8/20 0.50
BACE2 Q9Y5Z0 5/20 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
SCHEMBL6341824 0.96 BACE1 (0.51) BACE1CTSDBACE2
SCHEMBL6340335 0.92 BACE1 (0.57) BACE1CTSDBACE2
SCHEMBL6353564 0.92 BACE1 (0.50) BACE1CTSDBACE2
SCHEMBL6343253 0.92 BACE1 (0.59) BACE1CTSDBACE2
SCHEMBL6343249 0.92 BACE1 (0.54) BACE1CTSDBACE2
SCHEMBL6345205 0.91 BACE1 (0.53) BACE1CTSDBACE2
SCHEMBL6342931 0.91 BACE1 (0.49) BACE1CTSDBACE2
SCHEMBL6341668 0.91 BACE1 (0.53) BACE1CTSDBACE2
SCHEMBL6344498 0.88 BACE1 (0.62) BACE1CTSDBACE2
SCHEMBL6353540 0.88 BACE1 (0.58) 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 4 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 claimed
US-20030092747-A1 Aminediols for the treatment of Alzheimer's disease PHARMACIA & UPJOHN COMPANY 2003-05-15 US claimed
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 BACE1 1/4885CTSD 213/4885BACE2 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.