⚠ 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 | |
|---|---|---|---|---|
| Phosphine SCHEMBL28527573 | 0.87 | — | — | |
| Phosphine SCHEMBL28228577 | 0.82 | — | — | |
| Phosphine SCHEMBL10801373 | 0.82 | — | — | |
| Phosphine SCHEMBL867499 | 0.82 | — | — | |
| Phosphine SCHEMBL11793830 | 0.82 | — | — | |
| Phosphine SCHEMBL6401778 | 0.82 | — | — | |
| SCHEMBL831129 | 0.82 | — | — | |
| Phosphine SCHEMBL765319 | 0.82 | — | — | |
| Phosphine SCHEMBL11751660 | 0.78 | — | — | |
| Phosphine SCHEMBL25228035 | 0.67 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105851781-A | Stabilizing agent capable of realizing degradation, detoxication and harmless treatment of heavy metals in food, foodstuffs and traditional Chinese medicines and preparation method thereof | 李�杰 | 2016-08-17 | — | — | CN | disclosed |