⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20026 | 0.97 | — | — | |
| SCHEMBL22654552 | 0.97 | MAPT (0.32) | — | |
| SCHEMBL8578323 | 0.94 | — | — | |
| SCHEMBL28461314 | 0.94 | — | — | |
| Ethane SCHEMBL27991308 | 0.94 | MAPT (0.31) | — | |
| SCHEMBL28106645 | 0.94 | — | — | |
| SCHEMBL29221161 | 0.94 | — | — | |
| Ethylene SCHEMBL28090460 | 0.92 | MEN1 (0.30) | — | |
| Maleic Anhydride SCHEMBL8044382 | 0.87 | ALDH1A1 (0.31) | — | |
| Hexane SCHEMBL28307403 | 0.84 | ALDH1A1 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110051686-A | Composition comprising cross-linked cationic conjugated polymer | 瑞立普萨公司 | 2019-07-26 | — | — | CN | disclosed |
| CN-105451746-A | Compositions comprising crosslinked cationically binding polymers | RELYPSA INC | 2016-03-30 | — | — | CN | disclosed |