⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13333486 | 0.98 | — | — | |
| SCHEMBL13710885 | 0.93 | — | — | |
| SCHEMBL13670705 | 0.91 | PTGES (0.30) | — | |
| SCHEMBL13333607 | 0.90 | — | — | |
| SCHEMBL13670704 | 0.89 | — | — | |
| SCHEMBL13333491 | 0.87 | ESR1 (0.31) | — | |
| SCHEMBL13333929 | 0.87 | FFAR4 (0.30) | — | |
| SCHEMBL13333777 | 0.86 | ESR1 (0.31) | — | |
| SCHEMBL13760184 | 0.86 | — | — | |
| SCHEMBL14099992 | 0.85 | HTT (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2194110-A1 | Electroluminescent device using electroluminescent compounds | Gracel Display Inc. (KR) | 2010-06-09 | — | — | EP | disclosed |