⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11329423 | 0.73 | — | — | |
| SCHEMBL2754279 | 0.70 | — | — | |
| SCHEMBL2484822 | 0.69 | — | — | |
| SCHEMBL17185579 | 0.69 | — | — | |
| SCHEMBL14158086 | 0.67 | — | — | |
| SCHEMBL9830717 | 0.65 | — | — | |
| SCHEMBL15969104 | 0.65 | — | — | |
| SCHEMBL10665439 | 0.65 | — | — | |
| SCHEMBL2484819 | 0.64 | — | — | |
| SCHEMBL947168 | 0.61 | MEN1 (0.39) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110573520-B | Therapeutic agent and method for producing the same | 格莱科新诺威逊私人有限公司 | 2024-02-09 | — | — | CN | claimed |
| EP-0022975-B1 | TRIAZOLYL-ALKENE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES | BAYER AG (DE) | 1983-01-26 | — | — | EP | claimed |
| US-4331675-A | Combating fungi with triazolyl-alkenes | BAYER AKTIENGESELLSCHAFT (DE) | 1982-05-25 | — | — | US | claimed |
| CN-104974101-A | Synthesis method of triazole-olefin compound | Hubei university of science and technology | 2015-10-14 | — | — | CN | disclosed |
| US-4331675-A | Combating fungi with triazolyl-alkenes | BAYER AKTIENGESELLSCHAFT (DE) | 1982-05-25 | — | — | US | disclosed |
| US-4331675-A | Combating fungi with triazolyl-alkenes | BAYER AKTIENGESELLSCHAFT (DE) | 1982-05-25 | — | — | US | disclosed |
| US-4331675-A | Combating fungi with triazolyl-alkenes | BAYER AKTIENGESELLSCHAFT (DE) | 1982-05-25 | — | — | US | disclosed |
| EP-0022975-A1 | Triazolyl-alkene derivatives, process for their preparation and their use as fungicides | BAYER AG (DE) | 1981-01-28 | — | — | EP | disclosed |