⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL180347 | 0.91 | — | — | |
| SCHEMBL28915476 | 0.83 | — | — | |
| SCHEMBL1496344 | 0.83 | — | — | |
| SCHEMBL27913736 | 0.83 | — | — | |
| SCHEMBL9436324 | 0.83 | — | — | |
| SCHEMBL28858757 | 0.83 | — | — | |
| SCHEMBL11351540 | 0.83 | — | — | |
| SCHEMBL672197 | 0.83 | — | — | |
| SCHEMBL22076771 | 0.83 | — | — | |
| SCHEMBL29357869 | 0.83 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105284890-A | PCD (Intermixing Power of Chlorine or Calcium Peroxide) water-purification, sterilization and disinfection agent | CHONGQING ANGDUO ENVIRONMENTAL MAN CO LTD | 2016-02-03 | — | — | CN | claimed |
| CN-108782628-A | A kind of pure and fresh disinfectant of environment-friendly type air and preparation method thereof | 合肥华盖生物科技有限公司 | 2018-11-13 | — | — | CN | disclosed |
| CN-105284890-A | PCD (Intermixing Power of Chlorine or Calcium Peroxide) water-purification, sterilization and disinfection agent | CHONGQING ANGDUO ENVIRONMENTAL MAN CO LTD | 2016-02-03 | — | — | CN | disclosed |