⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3686670 | 1.00 | — | — | |
| SCHEMBL7753133 | 1.00 | — | — | |
| SCHEMBL7757270 | 1.00 | — | — | |
| SCHEMBL7757287 | 1.00 | — | — | |
| SCHEMBL7755810 | 0.79 | CHRM1 (0.30) | — | |
| SCHEMBL7757731 | 0.79 | CHRM1 (0.30) | — | |
| SCHEMBL7755804 | 0.79 | CHRM1 (0.30) | — | |
| SCHEMBL7753095 | 0.79 | CHRM1 (0.30) | — | |
| SCHEMBL7755788 | 0.79 | CHRM1 (0.30) | — | |
| SCHEMBL7755779 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3218457-B1 | IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2019-01-02 | — | — | EP | disclosed |
| US-8093204-B2 | Organic compounds | GIVAUDAN SA (CH) | 2012-01-10 | — | — | US | disclosed |
| EP-2155644-B1 | ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2010-11-17 | — | — | EP | disclosed |
| US-20100173821-A1 | Organic Compounds | GIVAUDAN SA (CH) | 2010-07-08 | — | — | US | disclosed |
| EP-0761664-B1 | Camphor derivatives as new odorants | GIVAUDAN SA (CH) | 2001-03-14 | — | — | EP | disclosed |