⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7055043 | 1.00 | — | — | |
| SCHEMBL7055095 | 0.91 | CAPN9 (0.32) | — | |
| SCHEMBL7055092 | 0.91 | CAPN9 (0.32) | — | |
| SCHEMBL7051686 | 0.86 | — | — | |
| SCHEMBL7054743 | 0.86 | — | — | |
| SCHEMBL7054746 | 0.86 | — | — | |
| SCHEMBL7051689 | 0.86 | — | — | |
| SCHEMBL7049838 | 0.85 | EPAS1 (0.35) | — | |
| SCHEMBL7049834 | 0.85 | EPAS1 (0.35) | — | |
| SCHEMBL7054946 | 0.84 | — | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0706396-B1 | 1,2,3,4-TETRAHYDROQUINOLINE-2,3,4-TRIONE-3 OR 4-OXIMES AND USE | OREGON STATE (US) | 2003-05-02 | — | — | EP | disclosed |
| US-5652368-A | NERVOUS SYSTEM DISORDERS, ALZHEIMER'S DISEASE | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1997-07-29 | — | — | US | disclosed |
| US-5475007-A | Preventing convulsions | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1995-12-12 | — | — | US | disclosed |