⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28791801 | 0.83 | — | — | |
| SCHEMBL9643382 | 0.80 | — | — | |
| SCHEMBL2077030 | 0.74 | — | — | |
| SCHEMBL6714704 | 0.74 | — | — | |
| SCHEMBL28100808 | 0.72 | — | — | |
| SCHEMBL9418544 | 0.65 | — | — | |
| SCHEMBL10442074 | 0.64 | — | — | |
| SCHEMBL569018 | 0.63 | — | — | |
| SCHEMBL1140316 | 0.63 | — | — | |
| SCHEMBL30601954 | 0.63 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107814798-B | 3-substituted acrylic acid compound and preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2020-11-03 | — | — | CN | disclosed |
| EP-0436348-B1 | Pyridyl cyclopropane derivatives with fungicidal activity | ZENECA LTD (GB) | 1996-11-13 | — | — | EP | disclosed |
| US-5126338-A | FUNGICIDES WHICH ARE N-PYRIDYL-CYCLOPROPANE CARBOXAMIDES OR DERIVATIVES THEREOF | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-06-30 | — | — | US | disclosed |
| US-5047415-A | Fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 1991-09-10 | — | — | US | disclosed |
| EP-0436348-A2 | Pyridyl cyclopropane derivatives with fungicidal activity | ZENECA LIMITED (GB) | 1991-07-10 | — | — | EP | disclosed |