⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23925030 | 1.00 | — | — | |
| SCHEMBL23925032 | 1.00 | — | — | |
| SCHEMBL23925120 | 0.85 | — | — | |
| SCHEMBL23925121 | 0.85 | — | — | |
| SCHEMBL23925068 | 0.85 | — | — | |
| SCHEMBL25302335 | 0.75 | — | — | |
| SCHEMBL23925074 | 0.75 | — | — | |
| SCHEMBL23925069 | 0.75 | — | — | |
| SCHEMBL23925130 | 0.73 | POLB (0.33) | — | |
| SCHEMBL23924912 | 0.73 | POLB (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4097199-A1 | ODORANT COMPOUND | Firmenich SA (CH) | 2022-12-07 | — | — | EP | disclosed |
| WO-2021209393-A1 | ODORANT COMPOUND | FIRMENICH SA (CH) | 2021-10-21 | — | — | WO | disclosed |