⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14324852 | 0.83 | ALDH1A1 (0.30) | — | |
| SCHEMBL2829806 | 0.82 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL2832724 | 0.82 | — | — | |
| SCHEMBL4984295 | 0.78 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL3674849 | 0.77 | — | — | |
| SCHEMBL3674041 | 0.77 | — | — | |
| SCHEMBL411486 | 0.77 | — | — | |
| SCHEMBL1907286 | 0.72 | PRKCA (0.33) | — | |
| SCHEMBL30438527 | 0.72 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL31608595 | 0.71 | — | — |
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-0129369-B2 | METHOD OF MANUFACTURING A COPOLYMER OF TRIOXANE | POLYPLASTICS CO. LTD. (JP) | 1992-04-15 | — | — | EP | claimed |
| EP-0129369-B1 | METHOD OF MANUFACTURING A COPOLYMER OF TRIOXANE | POLYPLASTICS CO. LTD. (JP) | 1988-09-14 | — | — | EP | claimed |