⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14730370 | 0.86 | — | — | |
| SCHEMBL14730214 | 0.86 | GPR119 (0.33) | — | |
| SCHEMBL14730298 | 0.82 | ALOX5AP (0.34) | — | |
| SCHEMBL14730192 | 0.81 | GPR119 (0.32) | — | |
| SCHEMBL14730245 | 0.79 | GPR119 (0.32) | — | |
| SCHEMBL14730233 | 0.78 | GPR119 (0.32) | — | |
| SCHEMBL12064777 | 0.77 | AOC3 (0.33) | — | |
| SCHEMBL14730213 | 0.77 | GPR119 (0.33) | — | |
| SCHEMBL470670 | 0.76 | GPR119 (0.36) | — | |
| SCHEMBL14730185 | 0.75 | GPR119 (0.34) | — |
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-2013026587-A1 | 1,4 DISUBSTITUTED PYRROLIDINE - 3 - YL -AMINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS | PROSIDION LIMITED (GB) | 2013-02-28 | — | — | WO | disclosed |