⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25851162 | 0.94 | — | — | |
| SCHEMBL24812447 | 0.87 | AHR (0.33) | — | |
| SCHEMBL24653357 | 0.84 | AHR (0.33) | — | |
| SCHEMBL26427845 | 0.81 | AHR (0.31) | — | |
| SCHEMBL25626381 | 0.81 | AHR (0.37) | — | |
| SCHEMBL25631776 | 0.80 | ALOX5 (0.36) | — | |
| SCHEMBL26428623 | 0.80 | — | — | |
| SCHEMBL25633008 | 0.80 | PLA2G2A (0.32) | — | |
| SCHEMBL19784416 | 0.80 | MMP12 (0.35) | — | |
| SCHEMBL25631854 | 0.78 | PLA2G2A (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-20230225183-A1 | LIGHT EMITTING ELEMENT AND POLYCYCLIC COMPOUND FOR LIGHT EMITTING ELEMENT | SAMSUNG DISPLAY CO., LTD. (KR) | 2023-07-13 | — | — | US | disclosed |