⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27383162 | 0.86 | — | — | |
| SCHEMBL190635 | 0.76 | — | — | |
| SCHEMBL1795530 | 0.76 | — | — | |
| Bromide SCHEMBL5908220 | 0.74 | SMN1; SMN2 (0.48) | — | |
| Hydrochloric Acid SCHEMBL22532201 | 0.74 | SMN1; SMN2 (0.43) | — | |
| SCHEMBL12862676 | 0.73 | SMN1; SMN2 (0.46) | — | |
| SCHEMBL965758 | 0.73 | — | — | |
| SCHEMBL10830265 | 0.73 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL28072097 | 0.72 | HSD17B10 (0.49) | — | |
| SCHEMBL27724787 | 0.71 | SMN1; SMN2 (0.40) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090281142-A1 | THIAZOLE DERIVATIVE | ASTELLAS PHARMA INC. (JP) | 2009-11-12 | — | — | US | disclosed |
| EP-1921074-A1 | THIAZOLE DERIVATIVE | Astellas Pharma Inc. (JP) | 2008-05-14 | — | — | EP | disclosed |