⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13615790 | 1.00 | — | — | |
| SCHEMBL13615973 | 0.99 | — | — | |
| SCHEMBL13615796 | 0.99 | — | — | |
| SCHEMBL13615830 | 0.87 | — | — | |
| SCHEMBL16773382 | 0.83 | ALDH1A1 (0.38) | — | |
| SCHEMBL13508013 | 0.82 | — | — | |
| SCHEMBL13508107 | 0.82 | PTGER4 (0.30) | — | |
| SCHEMBL13339229 | 0.81 | — | — | |
| SCHEMBL13507163 | 0.81 | PTGER4 (0.31) | — | |
| SCHEMBL13507621 | 0.81 | KDM4E (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20090273278-A1 | Novel organic electroluminescent compounds and organic electroluminescent device using the same | GRACEL DISPLAY INC. (KR) | 2009-11-05 | — | — | US | disclosed |