⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22663732 | 0.95 | — | — | |
| SCHEMBL22663860 | 0.94 | KDM4E (0.32) | — | |
| SCHEMBL22663973 | 0.94 | — | — | |
| SCHEMBL22663791 | 0.94 | — | — | |
| SCHEMBL10331195 | 0.92 | — | — | |
| SCHEMBL22663862 | 0.90 | KDM4E (0.34) | — | |
| SCHEMBL10331268 | 0.89 | PDK2 (0.34) | — | |
| SCHEMBL22663975 | 0.88 | KDM4E (0.32) | — | |
| SCHEMBL10331200 | 0.88 | — | — | |
| SCHEMBL10331208 | 0.88 | PDK2 (0.32) | — |
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-20200365813-A1 | ORGANIC ELECTROLUMINESCENCE ELEMENT | HODOGAYA CHEMICAL CO., LTD. (JP) | 2020-11-19 | — | — | US | disclosed |