⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4160084 | 0.68 | — | — | |
| SCHEMBL9087591 | 0.51 | — | — | |
| SCHEMBL11358436 | 0.50 | — | — | |
| SCHEMBL7593965 | 0.47 | — | — | |
| SCHEMBL11802296 | 0.47 | LMNA (0.33) | — | |
| SCHEMBL1493536 | 0.46 | ALDH1A1 (0.39) | — | |
| SCHEMBL29035860 | 0.45 | — | — | |
| SCHEMBL27648274 | 0.45 | — | — | |
| SCHEMBL9579807 | 0.45 | CYP3A4 (0.35) | — | |
| SCHEMBL28260849 | 0.45 | ALDH1A1 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4474774-A | Acridone substituted phosphorus compounds, compositions containing same and insecticidal method of use | VELSICOL CHEMICAL CORPORATION (US) | 1984-10-02 | — | — | US | disclosed |