⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22181313 | 0.93 | — | — | |
| SCHEMBL16890266 | 0.89 | CA12 (0.31) | — | |
| SCHEMBL30542945 | 0.86 | GPR84 (0.33) | — | |
| SCHEMBL23406350 | 0.86 | GPR84 (0.33) | — | |
| SCHEMBL23432342 | 0.86 | GPR84 (0.34) | — | |
| SCHEMBL23432434 | 0.85 | GPR84 (0.32) | — | |
| SCHEMBL23432417 | 0.84 | GPR84 (0.31) | — | |
| SCHEMBL23432165 | 0.84 | — | — | |
| SCHEMBL23432400 | 0.83 | GPR84 (0.34) | — | |
| SCHEMBL30542936 | 0.83 | GPR84 (0.34) | — |
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-11600790-B2 | Polycyclic aromatic compound for organic electroluminescent device | KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) | 2023-03-07 | — | — | US | disclosed |
| US-20210167288-A1 | POLYCYCLIC AROMATIC COMPOUND | KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) | 2021-06-03 | — | — | US | disclosed |