⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL584200 | 0.87 | — | — | |
| SCHEMBL1571988 | 0.71 | OPRM1 (0.30) | — | |
| SCHEMBL23793962 | 0.60 | CRBN (0.30) | — | |
| SCHEMBL2220255 | 0.58 | — | — | |
| SCHEMBL23793964 | 0.58 | GRIN1 (0.33) | — | |
| SCHEMBL23869815 | 0.58 | GRIN1 (0.33) | — | |
| SCHEMBL23869840 | 0.58 | GRIN1 (0.33) | — | |
| Acetic Acid SCHEMBL27607093 | 0.56 | CRBN (0.77) | — | |
| SCHEMBL23794163 | 0.56 | GRIN1 (0.37) | — | |
| SCHEMBL8903859 | 0.55 | ALDH1A1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0065189-A2 | Heterocyclic dihalo-acetamides, process for their preparation and herbicidal agents containing acetanilides as herbicidal agents and these dihalo-acetamides as antagonists | BASF Aktiengesellschaft (DE) | 1982-11-24 | — | — | EP | disclosed |