⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31697963 | 0.78 | UGT2B7 (0.31) | — | |
| SCHEMBL24475288 | 0.73 | CYP3A4 (0.33) | — | |
| SCHEMBL22614869 | 0.73 | — | — | |
| SCHEMBL21034812 | 0.72 | — | — | |
| SCHEMBL5199760 | 0.71 | GAA (0.32) | — | |
| SCHEMBL21001136 | 0.70 | CYP3A4 (0.32) | — | |
| SCHEMBL3697329 | 0.67 | CYP3A4 (0.41) | — | |
| SCHEMBL27565527 | 0.66 | — | — | |
| SCHEMBL22614839 | 0.64 | CYP3A4 (0.30) | — | |
| SCHEMBL8906299 | 0.62 | CYP3A4 (0.37) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1411110-B1 | Spiro compounds as perfuming ingredients | FIRMENICH & CIE (CH) | 2007-08-22 | — | — | EP | claimed |
| US-7256170-B2 | Spiro compounds as perfuming ingredients | FIRMENICH SA (CH) | 2007-08-14 | — | — | US | claimed |
| EP-1411110-A1 | Spiro compounds as perfuming ingredients | FIRMENICH SA (CH) | 2004-04-21 | — | — | EP | claimed |
| US-20040072721-A1 | Spiro compounds as perfuming ingredients | FIRMENICH SA (CH) | 2004-04-15 | — | — | US | claimed |
| EP-1411110-B1 | Spiro compounds as perfuming ingredients | FIRMENICH & CIE (CH) | 2007-08-22 | — | — | EP | disclosed |
| CN-1333059-C | Spiro-compound used as perfume component | FIRMENICH & CIE (CH) | 2007-08-22 | — | — | CN | disclosed |
| US-7256170-B2 | Spiro compounds as perfuming ingredients | FIRMENICH SA (CH) | 2007-08-14 | — | — | US | disclosed |
| CN-1496735-A | Spiro-compound used as perfume component | — | 2004-05-19 | — | — | CN | disclosed |
| EP-1411110-A1 | Spiro compounds as perfuming ingredients | FIRMENICH SA (CH) | 2004-04-21 | — | — | EP | disclosed |
| US-20040072721-A1 | Spiro compounds as perfuming ingredients | FIRMENICH SA (CH) | 2004-04-15 | — | — | US | disclosed |