⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28953103 | 0.72 | — | — | |
| SCHEMBL3854068 | 0.64 | — | — | |
| SCHEMBL28583943 | 0.64 | — | — | |
| SCHEMBL3854073 | 0.64 | — | — | |
| SCHEMBL3630248 | 0.64 | — | — | |
| SCHEMBL28832588 | 0.64 | — | — | |
| SCHEMBL7532225 | 0.64 | — | — | |
| SCHEMBL21121095 | 0.64 | — | — | |
| SCHEMBL21121419 | 0.64 | — | — | |
| SCHEMBL775491 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| 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 |