⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11299951 | 0.73 | — | — | |
| SCHEMBL7047141 | 0.60 | — | — | |
| SCHEMBL7079561 | 0.53 | — | — | |
| Calcium Chloride SCHEMBL5381230 | 0.45 | — | — | |
| SCHEMBL20781 | 0.43 | — | — | |
| Calcium Chloride SCHEMBL23441478 | 0.41 | — | — | |
| Calcium Chloride SCHEMBL22532692 | 0.41 | — | — | |
| Calcium Chloride SCHEMBL23803973 | 0.41 | — | — | |
| Calcium Chloride SCHEMBL20577233 | 0.41 | — | — | |
| Calcium Chloride SCHEMBL21751993 | 0.41 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110627773-B | Deuterated MGL-3196 compound and application thereof | 海创药业股份有限公司 | 2021-03-19 | — | — | CN | disclosed |
| CN-110627773-A | Deuterated MGL-3196 compound and application thereof | 成都海创药业有限公司 | 2019-12-31 | — | — | CN | disclosed |