⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13863004 | 0.94 | — | — | |
| SCHEMBL22403464 | 0.91 | PDK2 (0.32) | — | |
| SCHEMBL21917281 | 0.88 | — | — | |
| SCHEMBL24284563 | 0.87 | — | — | |
| SCHEMBL16366422 | 0.87 | PDK2 (0.34) | — | |
| SCHEMBL13849716 | 0.87 | PDK2 (0.30) | — | |
| SCHEMBL12770706 | 0.87 | PDK2 (0.35) | — | |
| SCHEMBL22755875 | 0.86 | — | — | |
| SCHEMBL23341319 | 0.86 | PDK2 (0.31) | — | |
| SCHEMBL13706496 | 0.86 | — | — |
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-2055709-A2 | Novel red electroluminescent compounds and organic electroluminescent device using the same | Gracel Display Inc. (KR) | 2009-05-06 | — | — | EP | disclosed |