⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20146089 | 0.92 | COMT (0.33) | — | |
| SCHEMBL13466070 | 0.86 | CNR1 (0.30) | — | |
| SCHEMBL10060873 | 0.85 | MEN1 (0.39) | — | |
| SCHEMBL18944905 | 0.84 | MEN1 (0.33) | — | |
| SCHEMBL10061813 | 0.82 | MEN1 (0.38) | — | |
| SCHEMBL20146062 | 0.82 | TUBB4A (0.36) | — | |
| SCHEMBL10061049 | 0.81 | L3MBTL1 (0.43) | — | |
| SCHEMBL15780935 | 0.81 | KDM4E (0.32) | — | |
| SCHEMBL20865089 | 0.80 | MEN1 (0.40) | — | |
| SCHEMBL20865096 | 0.80 | MEN1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2415772-B1 | MATERIAL FOR USE IN PHOSPHORESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME | NIPPON STEEL & SUMIKIN CHEM CO (JP) | 2018-05-16 | — | — | EP | disclosed |