⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24987879 | 0.95 | — | — | |
| SCHEMBL24988428 | 0.95 | — | — | |
| SCHEMBL24986421 | 0.94 | — | — | |
| SCHEMBL24985658 | 0.93 | — | — | |
| SCHEMBL24985686 | 0.92 | KDM4E (0.30) | — | |
| SCHEMBL24986580 | 0.91 | — | — | |
| SCHEMBL24399902 | 0.91 | KDM4E (0.32) | — | |
| SCHEMBL24988420 | 0.90 | — | — | |
| SCHEMBL24988365 | 0.90 | — | — | |
| SCHEMBL24987802 | 0.90 | KDM4E (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230019868-A1 | HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING HETEROCYCLIC COMPOUND, AND ELECTRONIC APPARATUS INCLUDING ORGANIC LIGHT-EMITTING DEVICE | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2023-01-19 | — | — | US | disclosed |