⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20343490 | 0.92 | — | — | |
| SCHEMBL10074547 | 0.82 | — | — | |
| SCHEMBL10002105 | 0.72 | — | — | |
| SCHEMBL2240992 | 0.71 | RAB9A (0.30) | — | |
| SCHEMBL16924935 | 0.71 | RAB9A (0.32) | — | |
| SCHEMBL4048481 | 0.70 | KDM4E (0.30) | — | |
| SCHEMBL16552220 | 0.69 | — | — | |
| SCHEMBL6260570 | 0.69 | — | — | |
| SCHEMBL8676968 | 0.69 | — | — | |
| SCHEMBL17179810 | 0.69 | NQO2 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070292681-A1 | Organic electroluminescence device | FUJI XEROX CO., LTD (JP) | 2007-12-20 | — | — | US | disclosed |
| US-20070292681-A1 | Organic electroluminescence device | FUJI XEROX CO., LTD (JP) | 2007-12-20 | — | — | US | disclosed |