⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23623056 | 0.91 | KDM4E (0.30) | — | |
| SCHEMBL23622641 | 0.90 | KDM4E (0.36) | — | |
| SCHEMBL23622639 | 0.85 | ALDH1A1 (0.33) | — | |
| SCHEMBL25564932 | 0.82 | KDM4E (0.36) | — | |
| SCHEMBL23622758 | 0.81 | KDM4E (0.36) | — | |
| SCHEMBL25564926 | 0.81 | KDM4E (0.34) | — | |
| SCHEMBL23622323 | 0.80 | — | — | |
| SCHEMBL24549520 | 0.80 | KDM4E (0.41) | — | |
| SCHEMBL25138183 | 0.79 | KDM4E (0.36) | — | |
| SCHEMBL25875053 | 0.79 | KDM4E (0.37) | — |
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-20210210700-A1 | ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES | UNIVERSAL DISPLAY CORPORATION (US) | 2021-07-08 | — | — | US | disclosed |