⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4663461 | 0.65 | — | — | |
| SCHEMBL117925 | 0.64 | — | — | |
| SCHEMBL654712 | 0.64 | — | — | |
| SCHEMBL5162533 | 0.61 | — | — | |
| SCHEMBL7933276 | 0.61 | — | — | |
| SCHEMBL284753 | 0.61 | — | — | |
| SCHEMBL8388968 | 0.61 | — | — | |
| SCHEMBL4665903 | 0.59 | — | — | |
| SCHEMBL4665781 | 0.59 | — | — | |
| SCHEMBL4665905 | 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-20080193700-A1 | Metal Chelates and Their Use in Optical Recording Media Having High Storage Capacity | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2008-08-14 | — | — | US | disclosed |
| EP-1710793-A1 | Metal chelate compounds and high capacity optical recording medium using the compounds | Ciba SC Holding AG (CH) | 2006-10-11 | — | — | EP | disclosed |