⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL716332 | 0.77 | — | — | |
| SCHEMBL25380334 | 0.74 | — | — | |
| SCHEMBL6788662 | 0.72 | — | — | |
| SCHEMBL7546520 | 0.72 | — | — | |
| SCHEMBL8096926 | 0.72 | — | — | |
| SCHEMBL20983780 | 0.72 | — | — | |
| SCHEMBL9268112 | 0.72 | — | — | |
| SCHEMBL8101888 | 0.69 | MEN1 (0.46) | — | |
| SCHEMBL14659742 | 0.67 | — | — | |
| SCHEMBL15257875 | 0.67 | PRKCA (0.53) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6114286-A | HERBICIDES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-09-05 | — | — | US | disclosed |
| EP-0947516-A1 | N-benzyl substituted, heterocyclic ring-fused pyrimidinone derivatives, their preparation and their use as herbicides | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1999-10-06 | — | — | EP | disclosed |