⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12554604 | 0.76 | — | — | |
| SCHEMBL13645490 | 0.76 | — | — | |
| SCHEMBL16349159 | 0.72 | — | — | |
| SCHEMBL4429690 | 0.67 | — | — | |
| SCHEMBL21974651 | 0.66 | — | — | |
| SCHEMBL17254969 | 0.63 | — | — | |
| SCHEMBL166398 | 0.61 | — | — | |
| SCHEMBL18080895 | 0.61 | — | — | |
| SCHEMBL8663205 | 0.60 | — | — | |
| SCHEMBL12521070 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1465880-B1 | 5-SULPHANYL-4H-1,2,4-TRIAZOLE DERIVATIVES AND THEIR USE TO TREAT DISORDERS ASSOCIATED WITH SOMATOSTATINE | IPSEN PHARMA (FR) | 2009-08-05 | — | — | EP | disclosed |