⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL879125 | 0.70 | — | — | |
| SCHEMBL2491272 | 0.70 | — | — | |
| Tert-Butylamine SCHEMBL20597076 | 0.68 | — | — | |
| SCHEMBL23365690 | 0.68 | — | — | |
| SCHEMBL2532689 | 0.67 | — | — | |
| SCHEMBL17589829 | 0.67 | — | — | |
| SCHEMBL6207063 | 0.64 | — | — | |
| SCHEMBL2259109 | 0.64 | — | — | |
| SCHEMBL608783 | 0.64 | — | — | |
| SCHEMBL13008117 | 0.64 | — | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021071806-A1 | ARYLMETHYLENE HETEROCYCLIC COMPOUNDS AS KV1.3 POTASSIUM SHAKER CHANNEL BLOCKERS | D. E. SHAW RESEARCH, LLC (US) | 2021-04-15 | — | — | WO | disclosed |
| EP-2986313-B1 | STABLE, PROTRACTED GLP-1/GLUCAGON RECEPTOR CO-AGONISTS FOR MEDICAL USE | NOVO NORDISK AS (DK) | 2019-06-12 | — | — | EP | disclosed |