⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13408727 | 0.97 | ALDH1A1 (0.31) | — | |
| SCHEMBL13408823 | 0.94 | HPGD (0.34) | — | |
| SCHEMBL13408873 | 0.91 | GPR84 (0.38) | — | |
| SCHEMBL13408875 | 0.88 | MCL1 (0.36) | — | |
| SCHEMBL13408736 | 0.87 | ALDH1A1 (0.31) | — | |
| SCHEMBL13445044 | 0.81 | — | — | |
| SCHEMBL753503 | 0.79 | KDM4E (0.30) | — | |
| SCHEMBL13615985 | 0.79 | — | — | |
| SCHEMBL13615802 | 0.79 | — | — | |
| SCHEMBL13706285 | 0.77 | CYP11B1 (0.41) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100096982-A1 | Novel organic electroluminescent compounds and organic electrouminescent device using the same | GRACEL DISPLAY INC. (KR) | 2010-04-22 | — | — | US | disclosed |
| US-20100096982-A1 | Novel organic electroluminescent compounds and organic electrouminescent device using the same | GRACEL DISPLAY INC. (KR) | 2010-04-22 | — | — | US | disclosed |