⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9891729 | 0.73 | — | — | |
| SCHEMBL15500218 | 0.69 | — | — | |
| SCHEMBL9486157 | 0.67 | — | — | |
| SCHEMBL2219660 | 0.65 | — | — | |
| SCHEMBL16002517 | 0.65 | — | — | |
| SCHEMBL14905888 | 0.65 | — | — | |
| SCHEMBL16002515 | 0.65 | — | — | |
| SCHEMBL845124 | 0.62 | — | — | |
| SCHEMBL18584210 | 0.61 | — | — | |
| SCHEMBL18588739 | 0.61 | — | — |
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-9115465-B2 | Preparations comprising disperse dye and/or UV absorber | DYSTAR COLOURS DISTRIBUTION GMBH (DE) | 2015-08-25 | — | — | US | disclosed |