⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15545657 | 0.78 | — | — | |
| SCHEMBL8386038 | 0.73 | — | — | |
| SCHEMBL8013219 | 0.72 | — | — | |
| SCHEMBL9193017 | 0.71 | TSHR (0.35) | — | |
| SCHEMBL134615 | 0.71 | TSHR (0.36) | — | |
| SCHEMBL8642915 | 0.70 | — | — | |
| SCHEMBL825742 | 0.70 | TSHR (0.39) | — | |
| SCHEMBL18871941 | 0.70 | — | — | |
| SCHEMBL10593600 | 0.70 | — | — | |
| SCHEMBL10544778 | 0.70 | — | — |
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-0542033-B1 | Use of pigment preparations for the manufacture of pastes, printing inks and paints | BASF AG (DE) | 1997-01-15 | — | — | EP | disclosed |