⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9505485 | 0.80 | — | — | |
| SCHEMBL15004583 | 0.78 | — | — | |
| SCHEMBL20152084 | 0.78 | ALDH1A1 (0.34) | — | |
| SCHEMBL361611 | 0.75 | — | — | |
| SCHEMBL5839545 | 0.74 | — | — | |
| SCHEMBL8099243 | 0.74 | — | — | |
| SCHEMBL18896198 | 0.74 | ADORA3 (0.41) | — | |
| Ammonia Solution, Strong SCHEMBL11220454 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL9135847 | 0.73 | — | — | |
| SCHEMBL22372054 | 0.72 | TDP1 (0.40) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118812306-A | Tetrazolyl energy-containing coordination polymer filled ferrocene derivative composite combustion speed catalyst | 陕西师范大学 | 2024-10-22 | — | — | CN | disclosed |
| WO-2019237318-A1 | CHEMICAL FOAMING AGENTS CONTAINING TOSYL GROUPS | DOW GLOBAL TECHNOLOGIES LLC (US) | 2019-12-19 | — | — | WO | disclosed |
| CN-104662007-B | Cystathionine gamma lyase (CSE) inhibitor | 索瓦制药公司 | 2018-03-16 | — | — | CN | disclosed |
| EP-2793589-B1 | HERBICIDAL COMPOUNDS | SYNGENTA LTD (GB) | 2017-12-20 | — | — | EP | disclosed |
| US-9686986-B2 | Herbicidal compounds | SYNGENTA LIMITED (GB) | 2017-06-27 | — | — | US | disclosed |
| US-20160249618-A1 | HERBICIDAL COMPOUNDS | SYNGENTA LIMITED (GB) | 2016-09-01 | — | — | US | disclosed |
| US-9375012-B2 | Herbicidal compounds | SYNGENTA LIMITED (GB) | 2016-06-28 | — | — | US | disclosed |
| US-20140371067-A1 | HERBICIDAL COMPOUNDS | SYNGENTA LIMITED (GB) | 2014-12-18 | — | — | US | disclosed |
| EP-2793589-A1 | HERBICIDAL COMPOUNDS | Syngenta Limited (GB) | 2014-10-29 | — | — | EP | disclosed |
| WO-2013092834-A1 | HERBICIDAL COMPOUNDS | SYNGENTA LIMITED (GB) | 2013-06-27 | — | — | WO | disclosed |