⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18533882 | 0.80 | MEN1 (0.32) | — | |
| SCHEMBL20670441 | 0.77 | — | — | |
| SCHEMBL18533883 | 0.74 | — | — | |
| SCHEMBL21510250 | 0.74 | — | — | |
| SCHEMBL23308929 | 0.73 | FAAH (0.43) | — | |
| SCHEMBL22403031 | 0.72 | — | — | |
| SCHEMBL22705110 | 0.72 | — | — | |
| SCHEMBL18533863 | 0.71 | NPSR1 (0.38) | — | |
| SCHEMBL21694973 | 0.70 | — | — | |
| SCHEMBL26243950 | 0.70 | FAAH (0.32) | — |
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-3664173-A1 | ORGANIC ELECTROLUMINESCENCE ELEMENT CONTAINING COMPOUND HAVING BENZOAZOLE RING STRUCTURE | Hodogaya Chemical Co., Ltd. (JP) | 2020-06-10 | — | — | EP | disclosed |