⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL353390 | 0.72 | — | — | |
| SCHEMBL20545017 | 0.70 | — | — | |
| SCHEMBL9798575 | 0.69 | — | — | |
| SCHEMBL801878 | 0.68 | — | — | |
| SCHEMBL30369566 | 0.68 | — | — | |
| SCHEMBL25403386 | 0.68 | — | — | |
| SCHEMBL12777853 | 0.68 | — | — | |
| SCHEMBL12778686 | 0.68 | — | — | |
| SCHEMBL6027391 | 0.68 | — | — | |
| SCHEMBL12778693 | 0.68 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024071216-A1 | PYRAZOLE COMPOUND AND PEST CONTROL AGENT CONTAINING SAME AS ACTIVE INGREDIENT | 三井化学クロップ＆ライフソリューション株式会社 | 2024-04-04 | — | — | WO | disclosed |
| WO-2023171783-A1 | PYRAZOLE COMPOUND, AND NOXIOUS ORGANISM CONTROL AGENT CONTAINING SAME AS ACTIVE INGREDIENT | 三井化学アグロ株式会社 | 2023-09-14 | — | — | WO | disclosed |
| US-11077098-B2 | Opioid receptor ligands and methods of using and making same | TREVENA, INC. (US) | 2021-08-03 | — | — | US | disclosed |
| US-20180311222-A1 | Opioid Receptor Ligands And Methods Of Using And Making Same | TREVENA, INC. | 2018-11-01 | — | — | US | disclosed |