⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26064634 | 0.90 | TDP2 (0.30) | — | |
| SCHEMBL26064808 | 0.89 | — | — | |
| SCHEMBL26064845 | 0.88 | — | — | |
| SCHEMBL26064852 | 0.83 | — | — | |
| SCHEMBL26066437 | 0.81 | — | — | |
| SCHEMBL20466698 | 0.81 | — | — | |
| SCHEMBL20466700 | 0.80 | — | — | |
| SCHEMBL22480618 | 0.78 | RXRA (0.32) | — | |
| SCHEMBL20466706 | 0.77 | RXRA (0.30) | — | |
| SCHEMBL26606252 | 0.77 | PDK2 (0.37) | — |
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 |