⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13333496 | 0.93 | — | — | |
| SCHEMBL13333480 | 0.90 | — | — | |
| SCHEMBL13333905 | 0.88 | — | — | |
| SCHEMBL13333897 | 0.88 | CYP1A2 (0.32) | — | |
| SCHEMBL13710968 | 0.88 | — | — | |
| SCHEMBL13333981 | 0.87 | — | — | |
| SCHEMBL12014689 | 0.87 | PDK2 (0.31) | — | |
| SCHEMBL14330788 | 0.87 | PDK2 (0.31) | — | |
| SCHEMBL13333951 | 0.87 | — | — | |
| SCHEMBL15002775 | 0.86 | PDK2 (0.33) | — |
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-2194110-A1 | Electroluminescent device using electroluminescent compounds | Gracel Display Inc. (KR) | 2010-06-09 | — | — | EP | disclosed |