⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23050733 | 0.96 | — | — | |
| SCHEMBL13353912 | 0.90 | — | — | |
| SCHEMBL19593121 | 0.87 | ALDH1A1 (0.32) | — | |
| SCHEMBL13968324 | 0.87 | ALDH1A1 (0.32) | — | |
| SCHEMBL25825863 | 0.85 | — | — | |
| SCHEMBL18523979 | 0.84 | ALDH1A1 (0.38) | — | |
| SCHEMBL22384544 | 0.84 | — | — | |
| SCHEMBL13856144 | 0.82 | — | — | |
| SCHEMBL17297370 | 0.82 | — | — | |
| SCHEMBL19311722 | 0.81 | — | — |
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-3246963-B1 | ORGANIC LIGHT-EMITTING DEVICE | SAMSUNG DISPLAY CO LTD (KR) | 2023-05-31 | — | — | EP | disclosed |