SCHEMBL20813596

SCHEMBL20813596

Cc1cccc(C2(c3cccc(-c4cncnc4)c3)N=C(N)N(C)C2=O)c1

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 19/20 0.80
BACE2 Q9Y5Z0 14/20 0.80
CTSD P07339 8/20 0.77
REN P00797 1/20 0.73

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
SCHEMBL4240351 0.91 BACE1 (0.81) BACE1BACE2CTSD
SCHEMBL23190513 0.90 BACE1 (0.83) BACE1BACE2CTSDREN
SCHEMBL4318188 0.89 BACE1 (1.00) BACE1BACE2CTSDREN
SCHEMBL20625457 0.89 BACE1 (0.83) BACE1BACE2CTSD
SCHEMBL4522306 0.88 BACE1 (0.75) BACE1BACE2CTSDREN
SCHEMBL4307456 0.87 BACE1 (1.00) BACE1BACE2CTSDREN
SCHEMBL4782211 0.87 BACE1 (0.74) BACE1BACE2CTSDREN
SCHEMBL3537470 0.86 BACE1 (0.75) BACE1BACE2CTSDREN
SCHEMBL8238880 0.86 BACE1 (0.85) BACE1BACE2CTSDREN
SCHEMBL3583089 0.86 BACE1 (1.00) BACE1BACE2CTSDREN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11142505-B2 Compositions for APP-selective BACE inhibition and uses therefor THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-10-12 US disclosed
US-20210101879-A1 AMYLOID PROTEIN-SELECTIVE BACE INHIBITORS (ASBIs) FOR ALZHEIMER?S DISEASE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-04-08 US disclosed
US-20190077766-A1 Compositions For APP-Selective BACE Inhibition And Uses Therefor NANTNEURO, LLC 2019-03-14 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 (3 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-20190077766-A1 Compositions For APP-Selective BACE Inhibition And Uses Therefor BACE1, BACE2, APP BACE1 1/4885BACE2 2/4885CTSD 88/4885
US-20210101879-A1 AMYLOID PROTEIN-SELECTIVE BACE INHIBITORS (ASBIs) FOR ALZHEIMER?S DISEASE APP, BACE1, BACE2 BACE1 2/4885BACE2 3/4885CTSD 717/4885
US-11142505-B2 Compositions for APP-selective BACE inhibition and uses therefor BACE1, BACE2, APP BACE1 1/4885BACE2 2/4885CTSD 88/4885

“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.