⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL970110 | 0.78 | — | — | |
| Bromide SCHEMBL28645412 | 0.77 | — | — | |
| SCHEMBL6991521 | 0.71 | — | — | |
| SCHEMBL28855042 | 0.71 | — | — | |
| Glyoxylate SCHEMBL8429578 | 0.69 | HTT (0.51) | — | |
| Acetic Acid SCHEMBL8425256 | 0.69 | HTT (0.55) | — | |
| SCHEMBL115952 | 0.69 | — | — | |
| SCHEMBL28242378 | 0.69 | — | — | |
| SCHEMBL27600813 | 0.69 | NPC1 (0.50) | — | |
| SCHEMBL1369210 | 0.69 | ALDH1A1 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101636073-B | The seed of bag quilt and manufacture bag are by the method for seed | VAMTECH LLC (US) | 2016-04-27 | — | — | CN | disclosed |