⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29955334 | 0.72 | ALDH1A1 (0.52) | — | |
| SCHEMBL29952172 | 0.69 | ALDH1A1 (0.32) | — | |
| SCHEMBL29956761 | 0.69 | GLS (0.53) | — | |
| SCHEMBL29951525 | 0.69 | APAF1 (0.49) | — | |
| SCHEMBL29954122 | 0.68 | ALDH1A1 (0.33) | — | |
| SCHEMBL13066637 | 0.60 | CCR1 (0.34) | — | |
| SCHEMBL22151221 | 0.57 | ADORA2A (0.39) | — | |
| SCHEMBL15157117 | 0.57 | L3MBTL1 (0.34) | — | |
| SCHEMBL22412584 | 0.54 | SMN1; SMN2 (0.39) | — | |
| SCHEMBL16416048 | 0.54 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2614826-B1 | Process for preparation of thiazole derivatives | DOW AGROSCIENCES LLC (US) | 2017-03-01 | — | — | EP | disclosed |