⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9593326 | 0.86 | — | — | |
| SCHEMBL3030202 | 0.78 | — | — | |
| SCHEMBL11057484 | 0.75 | — | — | |
| SCHEMBL11057503 | 0.75 | — | — | |
| SCHEMBL22157431 | 0.72 | — | — | |
| SCHEMBL22157428 | 0.72 | — | — | |
| SCHEMBL5859885 | 0.72 | — | — | |
| SCHEMBL25912743 | 0.72 | — | — | |
| SCHEMBL22157516 | 0.70 | — | — | |
| SCHEMBL1750372 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3618132-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT | NIPPON STEEL Chemical & Material Co., Ltd. (JP) | 2020-03-04 | — | — | EP | disclosed |