⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5199 | 0.96 | — | — | |
| SCHEMBL28150628 | 0.92 | — | — | |
| SCHEMBL28125079 | 0.92 | — | — | |
| SCHEMBL28187828 | 0.92 | — | — | |
| Ethylene Glycol SCHEMBL28104135 | 0.92 | — | — | |
| SCHEMBL27802655 | 0.92 | — | — | |
| SCHEMBL28117467 | 0.92 | — | — | |
| SCHEMBL27660318 | 0.92 | — | — | |
| SCHEMBL28250798 | 0.92 | — | — | |
| Water SCHEMBL28309148 | 0.92 | — | — |
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-109187789-A | A kind of method of methyl mercury and ethyl mercury in measurement aquatic feeds | 中山出入境检验检疫局检验检疫技术中心 | 2019-01-11 | — | — | CN | disclosed |