⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL714228 | 0.97 | — | — | |
| Fluoride Ion SCHEMBL4887924 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL9645205 | 0.91 | — | — | |
| SCHEMBL27689204 | 0.79 | — | — | |
| SCHEMBL254444 | 0.75 | CA1 (0.33) | — | |
| Ammonia Solution, Strong SCHEMBL1420784 | 0.72 | CA1 (0.31) | — | |
| SCHEMBL11793529 | 0.72 | CA1 (0.31) | — | |
| SCHEMBL1537738 | 0.72 | CA1 (0.31) | — | |
| SCHEMBL6518481 | 0.72 | CA1 (0.31) | — | |
| SCHEMBL21049480 | 0.72 | CA1 (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-2000057721-A2 | EDIBLE SOLIDS FOR TREATMENT OF GLUCOSE METABOLISM DISORDERS | AKESIS PHARMACEUTICALS, INC. (US) | 2000-10-05 | — | — | WO | disclosed |