⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22722833 | 1.00 | — | — | |
| SCHEMBL16611345 | 1.00 | — | — | |
| SCHEMBL21941420 | 0.87 | FNTA (0.47) | — | |
| SCHEMBL16221800 | 0.80 | ALDH1A1 (0.34) | — | |
| SCHEMBL11592816 | 0.79 | SQLE (0.46) | — | |
| SCHEMBL13211884 | 0.79 | BTN3A1 (0.35) | — | |
| SCHEMBL11592813 | 0.79 | SQLE (0.46) | — | |
| SCHEMBL105444 | 0.78 | — | — | |
| SCHEMBL7599333 | 0.78 | ALDH1A1 (0.39) | — | |
| SCHEMBL7599337 | 0.78 | ALDH1A1 (0.39) | — |
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-3279300-B1 | FRAGRANCE COMPOSITION | KAO CORP (JP) | 2019-03-27 | — | — | EP | disclosed |
| EP-3279300-A1 | FRAGRANCE COMPOSITION | KAO CORPORATION (JP) | 2018-02-07 | — | — | EP | disclosed |
| EP-2857482-B1 | PERFUME COMPOSITION | KAO CORP (JP) | 2017-10-11 | — | — | EP | disclosed |
| US-9567550-B2 | Fragrance composition | KAO CORPORATION (JP) | 2017-02-14 | — | — | US | disclosed |
| US-20160376521-A1 | PERFUME COMPOSITION | KAO CORPORATION (JP) | 2016-12-29 | — | — | US | disclosed |
| EP-3075822-A1 | PERFUME COMPOSITION | Kao Corporation (JP) | 2016-10-05 | — | — | EP | disclosed |
| CN-104334701-B | Flavor compositions | 花王株式会社 | 2016-08-31 | — | — | CN | disclosed |
| US-20150118174-A1 | FRAGRANCE COMPOSITION | KAO CORPORATION (JP) | 2015-04-30 | — | — | US | disclosed |
| EP-2857482-A1 | PERFUME COMPOSITION | Kao Corporation (JP) | 2015-04-08 | — | — | EP | disclosed |
| CN-104334701-A | Perfume composition | KAO CORP | 2015-02-04 | — | — | CN | disclosed |