⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13043639 | 0.89 | PSMD14 (0.30) | — | |
| SCHEMBL13043620 | 0.78 | MAPK1 (0.37) | — | |
| SCHEMBL12725055 | 0.69 | POLB (0.37) | — | |
| SCHEMBL12589394 | 0.69 | — | — | |
| SCHEMBL12589405 | 0.69 | — | — | |
| SCHEMBL14700368 | 0.67 | — | — | |
| SCHEMBL12589391 | 0.65 | MAPT (0.36) | — | |
| SCHEMBL13043625 | 0.65 | INSR (0.39) | — | |
| SCHEMBL10061202 | 0.65 | PSMD14 (0.34) | — | |
| SCHEMBL12589401 | 0.65 | — | — |
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-7828858-B2 | Mixture of sulfide dyes | CIBA CORPORATION (US) | 2010-11-09 | — | — | US | disclosed |
| US-20090100610-A1 | Mixture of Sulfide Dyes | CIBA CORPORATION | 2009-04-23 | — | — | US | disclosed |