⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13615842 | 0.91 | ALDH1A1 (0.30) | — | |
| SCHEMBL15975773 | 0.86 | MEN1 (0.37) | — | |
| SCHEMBL17791407 | 0.82 | MEN1 (0.32) | — | |
| SCHEMBL18565489 | 0.80 | MAOB (0.37) | — | |
| SCHEMBL18565491 | 0.80 | HSP90AA1 (0.31) | — | |
| SCHEMBL13597334 | 0.80 | ALOX5 (0.30) | — | |
| SCHEMBL20277315 | 0.79 | MAPT (0.40) | — | |
| SCHEMBL20277144 | 0.79 | GPR3 (0.38) | — | |
| SCHEMBL20087482 | 0.77 | NPC1 (0.48) | — | |
| SCHEMBL22572809 | 0.77 | CYP1A2 (0.44) | — |
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-20090273278-A1 | Novel organic electroluminescent compounds and organic electroluminescent device using the same | GRACEL DISPLAY INC. (KR) | 2009-11-05 | — | — | US | disclosed |