⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13782696 | 0.90 | PGR (0.30) | — | |
| SCHEMBL13699128 | 0.87 | TDP2 (0.30) | — | |
| SCHEMBL13338048 | 0.85 | ESR2 (0.40) | — | |
| SCHEMBL18466727 | 0.81 | — | — | |
| SCHEMBL13662365 | 0.81 | — | — | |
| SCHEMBL18468597 | 0.78 | — | — | |
| SCHEMBL13816108 | 0.77 | — | — | |
| SCHEMBL20025845 | 0.77 | LPL (0.32) | — | |
| SCHEMBL20611369 | 0.77 | RARA (0.32) | — | |
| SCHEMBL16229302 | 0.77 | TDP2 (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-2067767-A1 | Novel organic electroluminescent compounds and organic electroluminescent device using the same | Gracel Display Inc. (KR) | 2009-06-10 | — | — | EP | disclosed |