⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29280220 | 0.98 | KDM4E (0.42) | — | |
| SCHEMBL409030 | 0.72 | KDM4E (0.55) | — | |
| SCHEMBL4728794 | 0.70 | KDM4E (0.52) | — | |
| Hydrochloric Acid SCHEMBL28670387 | 0.70 | KDM4E (0.53) | — | |
| Phosphine SCHEMBL17979775 | 0.70 | KDM4E (0.53) | — | |
| SCHEMBL15546309 | 0.70 | — | — | |
| SCHEMBL9519103 | 0.70 | ALDH1A1 (0.46) | — | |
| SCHEMBL3514513 | 0.70 | SRC (0.48) | — | |
| SCHEMBL119581 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL6749305 | 0.69 | KDM4E (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109422775-B | Organometallic compound, organic light-emitting device, and organic light-emitting device | 三星显示有限公司 | 2024-03-19 | — | — | CN | disclosed |