⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7193836 | 1.00 | — | — | |
| SCHEMBL9002383 | 0.73 | — | — | |
| SCHEMBL1680268 | 0.67 | — | — | |
| SCHEMBL2959209 | 0.67 | — | — | |
| SCHEMBL2959208 | 0.67 | — | — | |
| SCHEMBL4865545 | 0.67 | — | — | |
| SCHEMBL11238114 | 0.67 | — | — | |
| SCHEMBL562508 | 0.67 | — | — | |
| SCHEMBL24899616 | 0.65 | — | — | |
| SCHEMBL231877 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1874677-B | Nanoparticulate active substance formulations | BASF AG | 2011-04-06 | — | — | CN | disclosed |
| US-5013762-A | Method for the treatment of nematodes in soil using bromonitromethane | GREAT LAKES CHEMICAL CORPORATION (US) | 1991-05-07 | — | — | US | disclosed |