⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26064845 | 0.95 | — | — | |
| SCHEMBL26064808 | 0.94 | — | — | |
| SCHEMBL26064526 | 0.91 | PDK2 (0.32) | — | |
| SCHEMBL26064870 | 0.83 | — | — | |
| SCHEMBL20466697 | 0.82 | PDK2 (0.31) | — | |
| SCHEMBL13903642 | 0.80 | RXRA (0.38) | — | |
| SCHEMBL19829571 | 0.80 | PDK2 (0.37) | — | |
| SCHEMBL19673765 | 0.80 | — | — | |
| SCHEMBL26602770 | 0.80 | RXRA (0.32) | — | |
| SCHEMBL17690204 | 0.79 | PDK2 (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 |
|---|---|---|---|---|---|---|---|
| US-11744146-B2 | Amine-based compound and organic light-emitting device including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2023-08-29 | — | — | US | disclosed |