⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL228418 | 0.97 | — | — | |
| SCHEMBL22911634 | 0.78 | — | — | |
| SCHEMBL29020565 | 0.75 | — | — | |
| SCHEMBL2476295 | 0.70 | — | — | |
| SCHEMBL13039042 | 0.67 | — | — | |
| SCHEMBL3436797 | 0.65 | — | — | |
| SCHEMBL18976585 | 0.65 | — | — | |
| SCHEMBL17675714 | 0.65 | — | — | |
| SCHEMBL40833 | 0.65 | — | — | |
| SCHEMBL14412967 | 0.65 | — | — |
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-4734123-A | HERBICIDE | THE DOW CHEMICAL COMPANY (US) | 1988-03-29 | — | — | US | disclosed |
| EP-0244847-A1 | Novel sulfonamides and method of making | THE DOW CHEMICAL COMPANY (US) | 1987-11-11 | — | — | EP | disclosed |