⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21398077 | 0.87 | — | — | |
| SCHEMBL23866652 | 0.86 | GPR119 (0.31) | — | |
| SCHEMBL21398076 | 0.82 | CNR2 (0.30) | — | |
| SCHEMBL23554085 | 0.79 | — | — | |
| SCHEMBL23554083 | 0.74 | — | — | |
| SCHEMBL21398087 | 0.73 | GRM5 (0.34) | — | |
| SCHEMBL21398231 | 0.73 | — | — | |
| SCHEMBL25907305 | 0.72 | — | — | |
| SCHEMBL469209 | 0.69 | L3MBTL1 (0.31) | — | |
| SCHEMBL15931972 | 0.69 | HTT (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20210300907-A1 | COMPOUNDS CONTAINING BENZO[D][1,3]OXATHIOLE, BENZO[D][1,3]OXATHIOLE 3-OXIDE OR BENZO[D][1,3]OXATHIOLE 3,3-DIOXIDE AND METHODS/USES THEREOF AS AGONISTS OF G PROTEIN-COUPLED RECEPTOR 119 | PRAMANA PHARMACEUTICALS INC. (CA) | 2021-09-30 | — | — | US | disclosed |