⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25501668 | 0.93 | — | — | |
| SCHEMBL25501361 | 0.84 | — | — | |
| SCHEMBL23621712 | 0.83 | ALDH1A1 (0.30) | — | |
| SCHEMBL23621858 | 0.83 | ALDH1A1 (0.30) | — | |
| SCHEMBL23614799 | 0.83 | ALDH1A1 (0.32) | — | |
| SCHEMBL23614370 | 0.83 | ALDH1A1 (0.32) | — | |
| SCHEMBL23621689 | 0.83 | PLA2G2A (0.33) | — | |
| SCHEMBL23621636 | 0.83 | ALDH1A1 (0.32) | — | |
| SCHEMBL25962711 | 0.82 | — | — | |
| SCHEMBL25962137 | 0.82 | KDM4E (0.31) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11655206-B2 | Nitrogen-containing compound, electronic element, and electronic device | SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) | 2023-05-23 | — | — | US | disclosed |
| US-11655206-B2 | Nitrogen-containing compound, electronic element, and electronic device | SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) | 2023-05-23 | — | — | US | disclosed |