⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13862993 | 0.85 | — | — | |
| SCHEMBL13710893 | 0.85 | PDK2 (0.32) | — | |
| SCHEMBL18294182 | 0.85 | — | — | |
| SCHEMBL13699864 | 0.83 | — | — | |
| SCHEMBL13371991 | 0.82 | — | — | |
| SCHEMBL12770653 | 0.82 | PDK2 (0.38) | — | |
| SCHEMBL12770717 | 0.82 | PDK2 (0.38) | — | |
| SCHEMBL18854852 | 0.81 | — | — | |
| SCHEMBL13862797 | 0.81 | — | — | |
| SCHEMBL13511757 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2110376-A1 | Novel compounds for electronic material and organic electronic device using the same | Gracel Display Inc. (KR) | 2009-10-21 | — | — | EP | disclosed |
| EP-2100940-A2 | Organic electroluminescent device using organic electroluminescent compounds | Gracel Display Inc. (KR) | 2009-09-16 | — | — | EP | disclosed |