⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29955890 | 0.88 | — | — | |
| SCHEMBL29953441 | 0.87 | — | — | |
| SCHEMBL29954017 | 0.84 | — | — | |
| SCHEMBL15330240 | 0.84 | KMT2A (0.32) | — | |
| SCHEMBL28461548 | 0.83 | — | — | |
| SCHEMBL29110089 | 0.82 | — | — | |
| SCHEMBL29110091 | 0.82 | — | — | |
| SCHEMBL15331915 | 0.81 | HTR2C (0.32) | — | |
| SCHEMBL19393130 | 0.81 | — | — | |
| SCHEMBL15332614 | 0.80 | ADRA1A (0.33) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111943900-B | Isoxazoline derivatives and their use in agriculture | 宁夏苏融达化工有限公司 | 2023-11-17 | — | — | CN | disclosed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |
| CN-112794846-B | Ethyl isoxazoline derivative and application thereof | 宁夏苏融达化工有限公司 | 2022-09-20 | — | — | CN | disclosed |
| CN-111574509-B | Isoxazoline derivatives and their use in agriculture | 宁夏苏融达化工有限公司 | 2021-08-31 | — | — | CN | disclosed |
| CN-112794846-A | Ethyl isoxazoline derivative and application thereof | 东莞市东阳光农药研发有限公司 | 2021-05-14 | — | — | CN | disclosed |
| CN-111943900-A | Isoxazoline derivatives and their use in agriculture | 东莞市东阳光农药研发有限公司 | 2020-11-17 | — | — | CN | disclosed |
| CN-110511216-B | Isoxazoline derivatives and their use in agriculture | 东莞市东阳光农药研发有限公司 | 2020-09-11 | — | — | CN | disclosed |
| CN-111574509-A | Isoxazoline derivatives and their use in agriculture | 东莞市东阳光农药研发有限公司 | 2020-08-25 | — | — | CN | disclosed |
| CN-110511216-A | Isoxazoline derivative and its application in agricultural | DONGGUAN DONGYANGGUANG PESTICIDE RES AND DEVELOPMENT CO LTD | 2019-11-29 | — | — | CN | disclosed |
| EP-2430000-A2 | FUNGICIDE PYRAZOLE CARBOXAMIDES DERIVATIVES | Bayer CropScience Aktiengesellschaft (DE) | 2012-03-21 | — | — | EP | disclosed |
| WO-2010130767-A2 | FUNGICIDE PYRAZOLE CARBOXAMIDES DERIVATIVES | BAYER CROPSCIENCE AG (DE) | 2010-11-18 | — | — | WO | disclosed |