⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6415189 | 1.00 | — | — | |
| SCHEMBL6415176 | 0.82 | — | — | |
| SCHEMBL6415616 | 0.73 | — | — | |
| SCHEMBL6415619 | 0.73 | — | — | |
| SCHEMBL11185710 | 0.73 | — | — | |
| SCHEMBL10841225 | 0.67 | — | — | |
| SCHEMBL959277 | 0.65 | — | — | |
| SCHEMBL7871038 | 0.62 | — | — | |
| SCHEMBL10994292 | 0.62 | — | — | |
| Alcohol SCHEMBL29009581 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2900654-A1 | TETRAZOLINONE COMPOUNDS AND THEIR USE AS PESTICIDES | Sumitomo Chemical Company Limited (JP) | 2015-08-05 | — | — | EP | disclosed |
| US-20050066453-A1 | Photochromic dye | NEW PRISMATIC ENTERPRISE CO., LTD. (TW) | 2005-03-31 | — | — | US | disclosed |