⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1274350 | 0.92 | GAA (0.30) | — | |
| SCHEMBL13516165 | 0.89 | — | — | |
| SCHEMBL298983 | 0.83 | GAA (0.41) | — | |
| SCHEMBL998456 | 0.82 | — | — | |
| SCHEMBL13516494 | 0.81 | CYP1A2 (0.31) | — | |
| SCHEMBL4180248 | 0.79 | PDE2A (0.33) | — | |
| SCHEMBL999095 | 0.77 | ADRB2 (0.36) | — | |
| SCHEMBL289670 | 0.76 | CA1 (0.40) | — | |
| SCHEMBL13516625 | 0.74 | — | — | |
| SCHEMBL13508303 | 0.73 | POLB (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2456759-B1 | PESTICIDAL CARBOXAMIDES | BAYER CROPSCIENCE AG (DE) | 2017-04-19 | — | — | EP | disclosed |
| US-8822691-B2 | Pesticidal carboxamides | BAYER CROPSCIENCE AG (DE) | 2014-09-02 | — | — | US | disclosed |
| US-20120277185-A1 | Pesticidal Carboxamides | BAYER CROPSCIENDE AG (DE) | 2012-11-01 | — | — | US | disclosed |
| EP-2456759-A2 | PESTICIDAL CARBOXAMIDES | Bayer CropScience AG (DE) | 2012-05-30 | — | — | EP | disclosed |
| WO-2011009540-A2 | PESTICIDAL CARBOXAMIDES | BAYER CROPSCIENCE AG (DE) | 2011-01-27 | — | — | WO | disclosed |