⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15109751 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL17730390 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL933129 | 0.77 | — | — | |
| SCHEMBL1007421 | 0.75 | — | — | |
| SCHEMBL18281303 | 0.69 | — | — | |
| SCHEMBL6010298 | 0.65 | — | — | |
| SCHEMBL1431147 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL6779184 | 0.64 | — | — | |
| SCHEMBL5888235 | 0.63 | — | — | |
| SCHEMBL2230207 | 0.59 | — | — |
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-6355641-B1 | HYPOTENSIVE AGENTS AND WOUND HEALING AGENTS | SYNTEX (U.S.A.) LLC | 2002-03-12 | — | — | US | disclosed |
| WO-2000055143-A1 | OXAZOLONE DERIVATIVES AND THEIR USE AS ALPHA-1 ADRENORECEPTOR MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2000-09-21 | — | — | WO | disclosed |