⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15891843 | 0.87 | — | — | |
| SCHEMBL16731749 | 0.86 | — | — | |
| SCHEMBL14232372 | 0.78 | — | — | |
| SCHEMBL15891866 | 0.77 | KDR (0.34) | — | |
| SCHEMBL16731753 | 0.77 | — | — | |
| SCHEMBL18430461 | 0.77 | — | — | |
| SCHEMBL15891827 | 0.77 | KDR (0.30) | — | |
| SCHEMBL15596833 | 0.77 | KDR (0.30) | — | |
| SCHEMBL15891804 | 0.76 | — | — | |
| SCHEMBL15891830 | 0.76 | MEN1 (0.30) | — |
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-2638113-B1 | THIOPHENE AZO DYES AND LAUNDRY CARE COMPOSITIONS CONTAINING THE SAME | MILLIKEN & CO (US) | 2017-01-04 | — | — | EP | disclosed |