⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3463114 | 0.69 | — | — | |
| SCHEMBL234698 | 0.69 | — | — | |
| SCHEMBL7856417 | 0.58 | — | — | |
| SCHEMBL7854023 | 0.55 | NISCH (0.41) | — | |
| SCHEMBL7854306 | 0.55 | — | — | |
| SCHEMBL4935894 | 0.53 | SMN1; SMN2 (0.31) | — | |
| SCHEMBL7852100 | 0.53 | NISCH (0.44) | — | |
| SCHEMBL7855667 | 0.53 | NISCH (0.44) | — | |
| SCHEMBL7855758 | 0.53 | NISCH (0.44) | — | |
| SCHEMBL17036823 | 0.48 | CRBN (0.33) | — |
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-0499501-A2 | New macrocyclic nitrogen ligands, method for their preparation, metal complexes, diagnostic and therapeutic compositions | GUERBET S.A. (FR) | 1992-08-19 | — | — | EP | claimed |