⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19507574 | 0.96 | — | — | |
| SCHEMBL15138209 | 0.90 | KDM4E (0.33) | — | |
| SCHEMBL24972731 | 0.89 | — | — | |
| SCHEMBL15138405 | 0.89 | KDM4E (0.33) | — | |
| SCHEMBL19507586 | 0.88 | — | — | |
| SCHEMBL24946723 | 0.86 | — | — | |
| SCHEMBL24972463 | 0.85 | — | — | |
| SCHEMBL26149360 | 0.85 | ALK (0.32) | — | |
| SCHEMBL15138530 | 0.85 | — | — | |
| SCHEMBL24973631 | 0.84 | — | — |
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-2017183859-A1 | A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2017-10-26 | — | — | WO | disclosed |