⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22924841 | 0.86 | — | — | |
| SCHEMBL25933489 | 0.80 | — | — | |
| SCHEMBL19836693 | 0.80 | ALDH1A1 (0.33) | — | |
| SCHEMBL19141853 | 0.79 | — | — | |
| SCHEMBL18401458 | 0.79 | — | — | |
| SCHEMBL22924870 | 0.78 | PTGS1 (0.38) | — | |
| SCHEMBL20707589 | 0.78 | — | — | |
| SCHEMBL24088714 | 0.77 | GRIK1 (0.32) | — | |
| SCHEMBL22520802 | 0.76 | ALDH1A1 (0.30) | — | |
| SCHEMBL18780120 | 0.75 | ALDH1A1 (0.32) | — |
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-20210024507-A1 | Compounds | STEP PHARMA S A S (FR) | 2021-01-28 | — | — | US | disclosed |