⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7907761 | 1.00 | — | — | |
| SCHEMBL7906123 | 1.00 | — | — | |
| SCHEMBL21942646 | 0.85 | GBA1 (0.34) | — | |
| SCHEMBL7919118 | 0.78 | — | — | |
| SCHEMBL7910296 | 0.78 | — | — | |
| SCHEMBL9645685 | 0.77 | — | — | |
| SCHEMBL7906127 | 0.70 | — | — | |
| SCHEMBL7914543 | 0.70 | — | — | |
| SCHEMBL472649 | 0.69 | — | — | |
| SCHEMBL13077993 | 0.69 | — | — |
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-2010082612-A1 | IMIDAZOTHIAZOLE DERIVATIVE HAVING PROLINE RING STRUCTURE | 第一三共株式会社 (JP) | 2010-07-22 | — | — | WO | disclosed |