⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13507509 | 0.95 | — | — | |
| SCHEMBL13511510 | 0.87 | — | — | |
| SCHEMBL13507487 | 0.87 | — | — | |
| SCHEMBL13507274 | 0.84 | LIMK1 (0.34) | — | |
| SCHEMBL13507491 | 0.82 | — | — | |
| SCHEMBL13507428 | 0.81 | ALOX5 (0.34) | — | |
| SCHEMBL13507093 | 0.81 | HSD17B1 (0.32) | — | |
| SCHEMBL13507100 | 0.81 | ALDH1A1 (0.35) | — | |
| SCHEMBL13507415 | 0.81 | CA12 (0.35) | — | |
| SCHEMBL13507422 | 0.81 | KDM4E (0.30) | — |
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-20100032658-A1 | Novel organic electroluminescent compounds and organic electroluminescent device using the same | GRACEL DISPLAY INC. (KR) | 2010-02-11 | — | — | US | disclosed |
| US-20100032658-A1 | Novel organic electroluminescent compounds and organic electroluminescent device using the same | GRACEL DISPLAY INC. (KR) | 2010-02-11 | — | — | US | disclosed |