⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4352 | 0.93 | — | — | |
| SCHEMBL4252284 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL6442671 | 0.86 | — | — | |
| Bromide SCHEMBL31546681 | 0.86 | — | — | |
| SCHEMBL10251 | 0.77 | — | — | |
| Ammonia Solution, Strong SCHEMBL478154 | 0.76 | — | — | |
| Ammonia Solution, Strong SCHEMBL27951672 | 0.76 | — | — | |
| Benzene SCHEMBL1234535 | 0.76 | TP53 (0.33) | — | |
| SCHEMBL1668834 | 0.72 | — | — | |
| Carbon Tetrachloride SCHEMBL9762490 | 0.72 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103998991-B | Charging member, electrophotographic process cartridge, and electrophotographic apparatus | CANON KABUSHIKI KAISHA (JP) | 2016-01-20 | — | — | CN | disclosed |
| CN-103998991-A | Charging member, electrophotographic process cartridge, and electrophotographic apparatus | CANON KK | 2014-08-20 | — | — | CN | disclosed |
| US-20090131588-A1 | MODIFIED HYDROPHILIC POLYROTAXANE AND CROSS-LINKED POLYROTAXANE | NISSAN MOTOR CO., LTD. | 2009-05-21 | — | — | US | disclosed |
| CN-101248086-A | hypervalent compound | APLAGEN GMBH (DE) | 2008-08-20 | — | — | CN | disclosed |
| EP-1921105-A1 | MODIFIED HYDROPHILIC POLYROTAXANE AND CROSS-LINKED POLYROTAXANE | Nissan Motor Company Limited (JP) | 2008-05-14 | — | — | EP | disclosed |