⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9296753 | 0.95 | — | — | |
| SCHEMBL11195575 | 0.95 | — | — | |
| SCHEMBL9296752 | 0.95 | — | — | |
| Methane SCHEMBL27914892 | 0.67 | — | — | |
| SCHEMBL17860610 | 0.67 | — | — | |
| SCHEMBL24910398 | 0.67 | — | — | |
| SCHEMBL13648980 | 0.67 | — | — | |
| SCHEMBL10041254 | 0.67 | — | — | |
| SCHEMBL14088271 | 0.67 | — | — | |
| SCHEMBL851172 | 0.64 | — | — |
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-212356960-U | Be used for chemical industry effluent treatment plant | 江苏大彭环保科技有限公司 | 2021-01-15 | — | — | CN | disclosed |
| CN-212285197-U | Cleaning device for methylthio acetaldoxime | 江西宝瑞化工科技有限公司 | 2021-01-05 | — | — | CN | disclosed |
| CN-212291039-U | Quantitative methylthio acetaldoxime storage device | 江西宝瑞化工科技有限公司 | 2021-01-05 | — | — | CN | disclosed |