⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13428370 | 0.82 | ACHE (0.33) | — | |
| SCHEMBL13428432 | 0.78 | — | — | |
| SCHEMBL13408833 | 0.75 | EGFR (0.31) | — | |
| SCHEMBL13408719 | 0.74 | — | — | |
| SCHEMBL13009031 | 0.73 | ACHE (0.35) | — | |
| SCHEMBL13706375 | 0.73 | PDE6D (0.33) | — | |
| SCHEMBL13340259 | 0.73 | PDE6D (0.30) | — | |
| SCHEMBL13339229 | 0.71 | — | — | |
| SCHEMBL13408805 | 0.71 | — | — | |
| SCHEMBL13409062 | 0.71 | PDE6D (0.35) | — |
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-20100051106-A1 | Novel organic electroluminescent compounds and organic electroluminescent device using the same | GRACEL DISPLAY INC. (KR) | 2010-03-04 | — | — | US | disclosed |