⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8924168 | 0.78 | MAOA (0.30) | — | |
| SCHEMBL6800796 | 0.77 | — | — | |
| SCHEMBL9221588 | 0.77 | — | — | |
| SCHEMBL8190702 | 0.76 | — | — | |
| SCHEMBL9222926 | 0.76 | PTGES (0.31) | — | |
| SCHEMBL6794694 | 0.74 | RORC (0.31) | — | |
| SCHEMBL6970318 | 0.73 | GRM4 (0.32) | — | |
| SCHEMBL8300937 | 0.73 | — | — | |
| SCHEMBL7661919 | 0.72 | — | — | |
| SCHEMBL8948505 | 0.72 | — | — |
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-20040029734-A1 | Fused-benzene derivatives useful as herbicides | ISHIHARA SANGYO KAISHA, LTD. | 2004-02-12 | — | — | US | disclosed |
| US-6573218-B1 | Defoliants containing such as uracil and 1,4-benzoxazole or benzthiazole moieties | ISHIHARA SANGYO KAISHA, LTD. (JP) | 2003-06-03 | — | — | US | disclosed |
| EP-1111993-A4 | FUSED-BENZENE DERIVATIVES USEFUL AS HERBICIDES | ISHIHARA SANGYO KAISHA (JP) | 2002-12-04 | — | — | EP | disclosed |
| EP-1111993-A1 | FUSED-BENZENE DERIVATIVES USEFUL AS HERBICIDES | ISHIHARA SANGYO KAISHA, LTD. (JP) | 2001-07-04 | — | — | EP | disclosed |
| WO-2000013508-A1 | FUSED-BENZENE DERIVATIVES USEFUL AS HERBICIDES | ISHIHARA SANGYO KAISHA, LTD. (JP) | 2000-03-16 | — | — | WO | disclosed |