⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21150799 | 0.90 | — | — | |
| SCHEMBL21149429 | 0.89 | PGR (0.31) | — | |
| SCHEMBL21150512 | 0.88 | — | — | |
| SCHEMBL24246794 | 0.86 | MEN1 (0.31) | — | |
| SCHEMBL21150475 | 0.84 | — | — | |
| SCHEMBL24246797 | 0.82 | — | — | |
| SCHEMBL22214874 | 0.79 | CES2 (0.35) | — | |
| SCHEMBL21149941 | 0.78 | — | — | |
| SCHEMBL24246803 | 0.78 | — | — | |
| SCHEMBL15030788 | 0.75 | ALDH1A1 (0.36) | — |
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-11251380-B2 | Organic electroluminescence device and polycyclic compound for organic electroluminescence device | SAMSUNG DISPLAY CO., LTD. (KR) | 2022-02-15 | — | — | US | disclosed |
| US-20190214585-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE | SAMSUNG DISPLAY CO., LTD. (KR) | 2019-07-11 | — | — | US | disclosed |