⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27359724 | 0.73 | — | — | |
| SCHEMBL21944210 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL28766022 | 0.71 | — | — | |
| Iodide SCHEMBL29802107 | 0.71 | — | — | |
| Bromide SCHEMBL28070518 | 0.71 | — | — | |
| SCHEMBL17688443 | 0.69 | — | — | |
| SCHEMBL9453902 | 0.69 | — | — | |
| SCHEMBL29004315 | 0.69 | — | — | |
| SCHEMBL12334137 | 0.69 | — | — | |
| SCHEMBL17343837 | 0.68 | — | — |
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-2022121805-A1 | FUSED RING COMPOUND AS NAV1.8 INHIBITOR AND USE THEREOF | 成都康弘药业集团股份有限公司 | 2022-06-16 | — | — | WO | disclosed |
| CN-114591293-A | Fused ring compound as Nav1.8 inhibitor and application thereof | 成都康弘药业集团股份有限公司 | 2022-06-07 | — | — | CN | disclosed |