⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13782211 | 0.88 | PSMB5 (0.33) | — | |
| SCHEMBL13782359 | 0.87 | — | — | |
| SCHEMBL13523405 | 0.87 | — | — | |
| SCHEMBL13512277 | 0.76 | — | — | |
| SCHEMBL22838079 | 0.76 | CHRNB4 (0.33) | — | |
| SCHEMBL13523438 | 0.75 | — | — | |
| SCHEMBL13782569 | 0.75 | — | — | |
| SCHEMBL13706667 | 0.74 | — | — | |
| SCHEMBL13749712 | 0.73 | — | — | |
| SCHEMBL13782314 | 0.73 | CHRNB4 (0.40) | — |
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-2108690-A1 | Novel organic electroluminescent compounds and organic electroluminescent device using the same | Gracel Display Inc. (KR) | 2009-10-14 | — | — | EP | disclosed |