⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL42403 | 0.94 | — | — | |
| SCHEMBL16469634 | 0.88 | — | — | |
| SCHEMBL916133 | 0.88 | — | — | |
| SCHEMBL4457048 | 0.88 | — | — | |
| SCHEMBL8558807 | 0.88 | — | — | |
| SCHEMBL8936989 | 0.88 | — | — | |
| SCHEMBL1369955 | 0.88 | — | — | |
| SCHEMBL11400493 | 0.88 | — | — | |
| SCHEMBL4821699 | 0.88 | — | — | |
| SCHEMBL1367984 | 0.88 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107257677-B | Oral care compositions | 荷兰联合利华有限公司 | 2020-06-19 | — | — | CN | disclosed |
| EP-3258906-B1 | ORAL CARE COMPOSITION | UNILEVER PLC (GB) | 2019-07-10 | — | — | EP | disclosed |
| EP-3258906-A1 | ORAL CARE COMPOSITION | Unilever Plc. (GB) | 2017-12-27 | — | — | EP | disclosed |
| WO-2016131750-A1 | ORAL CARE COMPOSITION | UNILEVER PLC (GB) | 2016-08-25 | — | — | WO | disclosed |