⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5400085 | 0.77 | — | — | |
| SCHEMBL604086 | 0.77 | — | — | |
| SCHEMBL5410479 | 0.77 | — | — | |
| SCHEMBL2570021 | 0.77 | — | — | |
| SCHEMBL21796 | 0.77 | — | — | |
| SCHEMBL22716 | 0.73 | — | — | |
| SCHEMBL4595563 | 0.71 | — | — | |
| SCHEMBL2565925 | 0.71 | — | — | |
| SCHEMBL17556488 | 0.70 | — | — | |
| SCHEMBL303428 | 0.70 | CES2 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009142094-A1 | POLYETHER POLYMER AND PRODUCTION PROCESS THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2009-11-26 | — | — | WO | disclosed |