⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL177823 | 0.97 | — | — | |
| SCHEMBL27685628 | 0.94 | ALDH1A1 (0.37) | — | |
| SCHEMBL178230 | 0.94 | — | — | |
| SCHEMBL177636 | 0.94 | — | — | |
| SCHEMBL2348801 | 0.73 | POLB (0.50) | — | |
| SCHEMBL674966 | 0.71 | — | — | |
| Ammonia Solution, Strong SCHEMBL11793324 | 0.71 | POLB (0.56) | — | |
| Ammonia Solution, Strong SCHEMBL7990639 | 0.71 | — | — | |
| Ammonia Solution, Strong SCHEMBL11793333 | 0.71 | POLB (0.56) | — | |
| SCHEMBL27664620 | 0.71 | ALDH1A1 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0510246-B1 | Use of fine particulate crosslinked type n-vinylamide resin microgel | SHOWA DENKO KK (JP) | 1996-09-25 | — | — | EP | disclosed |
| EP-0510246-A1 | Use of fine particulate crosslinked type n-vinylamide resin microgel | SHOWA DENKO KABUSHIKI KAISHA (JP) | 1992-10-28 | — | — | EP | disclosed |