⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13224388 | 0.90 | — | — | |
| SCHEMBL2744052 | 0.90 | — | — | |
| SCHEMBL4561237 | 0.90 | — | — | |
| SCHEMBL3708456 | 0.90 | — | — | |
| SCHEMBL18755428 | 0.83 | — | — | |
| SCHEMBL18755385 | 0.83 | — | — | |
| SCHEMBL18755383 | 0.83 | — | — | |
| SCHEMBL18755373 | 0.82 | — | — | |
| SCHEMBL18755366 | 0.82 | — | — | |
| SCHEMBL13747439 | 0.82 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6001981-A | INSECTICIDES AND MITICIDES | DOW AGROSCIENCES LLC (US) | 1999-12-14 | — | — | US | disclosed |
| EP-0837870-A1 | SYNTHETIC MODIFICATION TO SPINOSYN COMPOUNDS | DOWELANCO (US) | 1998-04-29 | — | — | EP | disclosed |
| WO-1997000265-A1 | SYNTHETIC MODIFICATION TO SPINOSYN COMPOUNDS | DOWELANCO (US) | 1997-01-03 | — | — | WO | disclosed |