⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5050535 | 1.00 | — | — | |
| SCHEMBL3373676 | 0.97 | — | — | |
| SCHEMBL5703290 | 0.94 | ADH1A (0.48) | — | |
| SCHEMBL4570866 | 0.94 | ADH1A (0.48) | — | |
| SCHEMBL20197642 | 0.94 | ADH1A (0.48) | — | |
| SCHEMBL170201 | 0.94 | ADH1A (0.48) | — | |
| SCHEMBL21180049 | 0.94 | ADH1A (0.48) | — | |
| Water SCHEMBL28842264 | 0.92 | ADH1A (0.46) | — | |
| SCHEMBL4756581 | 0.90 | — | — | |
| SCHEMBL1678939 | 0.90 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008126684-A2 | AGRICULTURAL COMPOSITION FOR CONTROLLING OR PREVENTING PLANT DISEASES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2008-10-23 | — | — | WO | disclosed |