⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26409144 | 0.94 | — | — | |
| SCHEMBL24887820 | 0.93 | — | — | |
| SCHEMBL24356275 | 0.92 | — | — | |
| SCHEMBL24887281 | 0.91 | — | — | |
| SCHEMBL26409135 | 0.91 | PIM1 (0.30) | — | |
| SCHEMBL24374115 | 0.90 | HCRTR1 (0.30) | — | |
| SCHEMBL26409152 | 0.90 | — | — | |
| SCHEMBL24886817 | 0.90 | BACE1 (0.32) | — | |
| SCHEMBL26406115 | 0.89 | NISCH (0.30) | — | |
| SCHEMBL24890159 | 0.89 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020022769-A1 | A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2020-01-30 | — | — | WO | disclosed |