⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31459773 | 1.00 | — | — | |
| SCHEMBL31459719 | 1.00 | — | — | |
| SCHEMBL31132170 | 1.00 | — | — | |
| SCHEMBL14378044 | 1.00 | — | — | |
| SCHEMBL31132231 | 1.00 | — | — | |
| SCHEMBL31459675 | 1.00 | — | — | |
| SCHEMBL1874314 | 1.00 | — | — | |
| SCHEMBL31132257 | 1.00 | — | — | |
| SCHEMBL1302551 | 0.83 | — | — | |
| SCHEMBL1302548 | 0.83 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-12264349-B2 | Method for producing monoterpenoid compounds | JOHN INNES CENTRE (GB) | 2025-04-01 | — | — | US | disclosed |