⚠ 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 | |
|---|---|---|---|---|
| Glyoxylate SCHEMBL464597 | 0.95 | — | — | |
| Glyoxylate SCHEMBL28141904 | 0.95 | — | — | |
| Glyoxylate SCHEMBL28544801 | 0.95 | — | — | |
| Glyoxylate SCHEMBL29273168 | 0.95 | TSHR (0.46) | — | |
| Glyoxylate SCHEMBL27536523 | 0.91 | — | — | |
| Glyoxylate SCHEMBL15868 | 0.91 | — | — | |
| Glyoxylate SCHEMBL11690306 | 0.91 | TSHR (0.50) | — | |
| Glyoxylate SCHEMBL1518069 | 0.91 | TSHR (0.50) | — | |
| Glyoxylate SCHEMBL28116909 | 0.87 | — | — | |
| Glyoxylate SCHEMBL25310626 | 0.86 | — | — |
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-108473484-A | Compounds useful as TRPM8 modulators | 赛诺米克斯公司 | 2018-08-31 | — | — | CN | disclosed |