⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6573417 | 0.77 | ALDH1A1 (0.35) | — | |
| SCHEMBL11045907 | 0.77 | ALDH1A1 (0.35) | — | |
| SCHEMBL9512718 | 0.77 | — | — | |
| SCHEMBL1980632 | 0.77 | — | — | |
| SCHEMBL8486814 | 0.75 | ALDH1A1 (0.44) | — | |
| SCHEMBL7768006 | 0.74 | TSHR (0.43) | — | |
| Water SCHEMBL19327173 | 0.72 | ALDH1A1 (0.32) | — | |
| SCHEMBL92211 | 0.72 | — | — | |
| SCHEMBL2761532 | 0.72 | — | — | |
| SCHEMBL844187 | 0.72 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109418262-A | A kind of preservative and preparation method thereof | 三博生化科技（上海）有限公司 | 2019-03-05 | — | — | CN | claimed |
| CN-109418262-A | A kind of preservative and preparation method thereof | 三博生化科技（上海）有限公司 | 2019-03-05 | — | — | CN | disclosed |
| US-20160324159-A1 | PEST CONTROLLING METHOD, COMPOSITION, ELECTROSTATIC SPRAY DEVICE AND USE THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2016-11-10 | — | — | US | disclosed |
| CN-103079408-B | Pest controlling method, composition, electrostatic spray device and use thereof | SUMITOMO CHEMICAL CO | 2015-03-11 | — | — | CN | disclosed |
| EP-2613633-A1 | PEST CONTROLLING METHOD, COMPOSITION, ELECTROSTATIC SPRAY DEVICE AND USE THEREOF | Sumitomo Chemical Company Limited (JP) | 2013-07-17 | — | — | EP | disclosed |
| US-20130172409-A1 | PEST CONTROLLING METHOD, COMPOSITION, ELECTROSTATIC SPRAY DEVICE AND USE THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-07-04 | — | — | US | disclosed |
| WO-2012033214-A1 | PEST CONTROLLING METHOD, COMPOSITION, ELECTROSTATIC SPRAY DEVICE AND USE THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-03-15 | — | — | WO | disclosed |