⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30128865 | 1.00 | — | — | |
| SCHEMBL30128836 | 0.79 | CES2 (0.33) | — | |
| SCHEMBL30128715 | 0.79 | CES2 (0.33) | — | |
| SCHEMBL30128955 | 0.77 | CES2 (0.35) | — | |
| SCHEMBL30128702 | 0.74 | CES2 (0.34) | — | |
| SCHEMBL30128895 | 0.73 | CES2 (0.32) | — | |
| SCHEMBL30128736 | 0.73 | CES2 (0.32) | — | |
| SCHEMBL29185823 | 0.70 | ACE2 (0.33) | — | |
| Lyral SCHEMBL20605413 | 0.70 | CES2 (0.39) | — | |
| Lyral SCHEMBL112060 | 0.70 | CES2 (0.39) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240294470-A1 | FRAGRANCE COMPOUNDS | GIVAUDAN SA (CH) | 2024-09-05 | — | — | US | disclosed |
| EP-4355728-A1 | FRAGRANCE COMPOUNDS | Givaudan SA (CH) | 2024-04-24 | — | — | EP | disclosed |
| WO-2022261956-A1 | FRAGRANCE COMPOUNDS | GIVAUDAN SA (CH) | 2022-12-22 | — | — | WO | disclosed |
| WO-2022263605-A1 | FRAGRANCE COMPOUNDS | GIVAUDAN SA (CH) | 2022-12-22 | — | — | WO | disclosed |