⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19120 | 0.83 | — | — | |
| SCHEMBL10437034 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL11755196 | 0.77 | — | — | |
| SCHEMBL23671 | 0.73 | — | — | |
| SCHEMBL1023591 | 0.73 | — | — | |
| SCHEMBL24504 | 0.72 | — | — | |
| SCHEMBL4629335 | 0.72 | — | — | |
| SCHEMBL24098 | 0.72 | — | — | |
| SCHEMBL199511 | 0.72 | — | — | |
| SCHEMBL1030870 | 0.72 | — | — |
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-4451471-A | Certain 2,4,5-tri-substituted thiazoles, pharmaceutical compositions containing same and methods of using same | CIBA-GEIGY CORPORATION (US) | 1984-05-29 | — | — | US | disclosed |