⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5403744 | 1.00 | — | — | |
| SCHEMBL10760105 | 0.82 | — | — | |
| SCHEMBL10760861 | 0.72 | — | — | |
| SCHEMBL5407331 | 0.71 | — | — | |
| SCHEMBL5393860 | 0.71 | APOBEC3A (0.33) | — | |
| SCHEMBL5393852 | 0.62 | CNR2 (0.33) | — | |
| SCHEMBL4652558 | 0.61 | — | — | |
| SCHEMBL4652560 | 0.60 | — | — | |
| SCHEMBL9079442 | 0.57 | RXRA (0.36) | — | |
| SCHEMBL8733359 | 0.57 | RXRA (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7253141-B2 | Musk odorant compounds | FIRMENICH SA (CH) | 2007-08-07 | — | — | US | disclosed |
| EP-1689728-B1 | MUSK ODORANT COMPOUNDS | FIRMENICH & CIE (CH) | 2007-04-11 | — | — | EP | disclosed |
| US-20060211598-A1 | Musk odorant compounds | FIRMENICH SA (CH) | 2006-09-21 | — | — | US | disclosed |
| EP-1689728-A1 | MUSK ODORANT COMPOUNDS | FIRMENICH SA (CH) | 2006-08-16 | — | — | EP | disclosed |
| WO-2005054220-A1 | MUSK ODORANT COMPOUNDS | FIRMENICH SA (CH) | 2005-06-16 | — | — | WO | disclosed |