⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26064808 | 0.99 | — | — | |
| SCHEMBL26064852 | 0.95 | — | — | |
| SCHEMBL26064870 | 0.88 | — | — | |
| SCHEMBL26064526 | 0.85 | PDK2 (0.32) | — | |
| SCHEMBL26064890 | 0.83 | — | — | |
| SCHEMBL26064524 | 0.82 | — | — | |
| SCHEMBL13508981 | 0.80 | — | — | |
| SCHEMBL20466693 | 0.79 | RXRA (0.32) | — | |
| SCHEMBL20466692 | 0.79 | RXRA (0.32) | — | |
| SCHEMBL22480350 | 0.78 | RXRA (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11744146-B2 | Amine-based compound and organic light-emitting device including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2023-08-29 | — | — | US | disclosed |