⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4501780 | 0.69 | — | — | |
| SCHEMBL3272790 | 0.67 | — | — | |
| SCHEMBL4501391 | 0.67 | — | — | |
| SCHEMBL7366405 | 0.65 | — | — | |
| SCHEMBL721366 | 0.64 | — | — | |
| SCHEMBL4510129 | 0.63 | — | — | |
| SCHEMBL4510132 | 0.61 | — | — | |
| SCHEMBL270547 | 0.60 | — | — | |
| SCHEMBL270459 | 0.57 | — | — | |
| SCHEMBL723878 | 0.57 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20090042957-A1 | Substituted Oxyarenes | BAYER CROPSCIENCE AG (DE) | 2009-02-12 | — | — | US | claimed |
| US-20090042957-A1 | Substituted Oxyarenes | BAYER CROPSCIENCE AG (DE) | 2009-02-12 | — | — | US | disclosed |
| WO-2002024709-A2 | BICYCLODERIVATIVES AS HERBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2002-03-28 | — | — | WO | disclosed |
| WO-2002024704-A1 | NOVEL HERBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2002-03-28 | — | — | WO | disclosed |
| WO-2001030782-A2 | NOVEL HERBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2001-05-03 | — | — | WO | disclosed |