⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28026753 | 0.68 | — | — | |
| SCHEMBL6598232 | 0.62 | — | — | |
| SCHEMBL6589402 | 0.58 | — | — | |
| SCHEMBL8190100 | 0.58 | — | — | |
| SCHEMBL13647420 | 0.53 | — | — | |
| SCHEMBL24836713 | 0.53 | — | — | |
| SCHEMBL19018800 | 0.51 | ALDH1A1 (0.47) | — | |
| SCHEMBL18817874 | 0.47 | SCN1A (0.33) | — | |
| SCHEMBL15111216 | 0.46 | — | — | |
| SCHEMBL1201906 | 0.46 | SCN1A (0.32) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3197510-A1 | DELIVERY SYSTEMS COMPRISING MALODOR REDUCTION COMPOSITIONS | The Procter & Gamble Company (US) | 2017-08-02 | — | — | EP | claimed |
| WO-2016049458-A1 | DELIVERY SYSTEMS COMPRISING MALODOR REDUCTION COMPOSITIONS | THE PROCTER & GAMBLE COMPANY (US) | 2016-03-31 | — | — | WO | claimed |