⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2610830 | 0.81 | — | — | |
| SCHEMBL15150557 | 0.77 | — | — | |
| SCHEMBL1844819 | 0.77 | — | — | |
| SCHEMBL9693565 | 0.77 | — | — | |
| SCHEMBL23897024 | 0.77 | — | — | |
| SCHEMBL31173882 | 0.75 | KDM4E (0.40) | — | |
| SCHEMBL8683323 | 0.74 | KDM4E (0.43) | — | |
| SCHEMBL12341093 | 0.74 | KDM4E (0.38) | — | |
| SCHEMBL20604241 | 0.74 | APLNR (0.41) | — | |
| SCHEMBL20604242 | 0.74 | APLNR (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0364350-B1 | 4-Methyl-5[2-(4-phenyl-1-piperazinyl)-ethyl] thiazole derivatives, their preparation and pharmaceutical compositions containing them | INST RECH CHIM BIOLOG (FR) | 1994-01-12 | — | — | EP | claimed |
| US-5120736-A | Treatment of functional dysuria associated with hyperactivity of adrenergic smypathetic nervous system | INSTITUT DE RECHERCHES CHIMIQUES ET BIOLOGIQUES APPLIQUEES (FR) | 1992-06-09 | — | — | US | disclosed |