⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4354417 | 0.94 | GBA1 (0.31) | — | |
| SCHEMBL4349200 | 0.94 | GBA1 (0.31) | — | |
| SCHEMBL4350713 | 0.94 | GBA1 (0.31) | — | |
| SCHEMBL4363307 | 0.94 | GBA1 (0.31) | — | |
| SCHEMBL4352653 | 0.94 | GBA1 (0.31) | — | |
| SCHEMBL4362163 | 0.94 | GBA1 (0.31) | — | |
| SCHEMBL4352735 | 0.94 | GBA1 (0.31) | — | |
| SCHEMBL4354921 | 0.84 | NPC1 (0.33) | — | |
| SCHEMBL6532614 | 0.84 | — | — | |
| SCHEMBL4359465 | 0.83 | NPC1 (0.31) | — |
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 |