⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3928808 | 1.00 | — | — | |
| SCHEMBL2896865 | 1.00 | — | — | |
| SCHEMBL17798814 | 1.00 | — | — | |
| SCHEMBL4559443 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL4062230 | 0.98 | GAA (0.37) | — | |
| Methane SCHEMBL29180228 | 0.98 | GAA (0.33) | — | |
| Hydrochloric Acid SCHEMBL5457644 | 0.98 | GAA (0.37) | — | |
| SCHEMBL24862658 | 0.78 | — | — | |
| SCHEMBL532330 | 0.77 | — | — | |
| SCHEMBL9203898 | 0.77 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20250250287-A1 | HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH | BEIGENE SWITZERLAND GMBH (CH) | 2025-08-07 | — | — | US | disclosed |
| EP-4568973-A1 | HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH | BeiGene Switzerland GmbH (CH) | 2025-06-18 | — | — | EP | disclosed |
| CN-119654327-A | Heterocyclic compounds, compositions thereof and methods of treatment thereof | 百济神州(苏州)生物科技有限公司 | 2025-03-18 | — | — | CN | disclosed |
| WO-2024032703-A1 | HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH | BEIGENE, LTD. (KY) | 2024-02-15 | — | — | WO | disclosed |
| US-7632829-B2 | Diazepan derivatives | HOFFMANN-LA ROCHE INC. (US) | 2009-12-15 | — | — | US | disclosed |