⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29170513 | 0.76 | — | — | |
| SCHEMBL6472392 | 0.74 | — | — | |
| SCHEMBL3455316 | 0.72 | TP53 (0.33) | — | |
| SCHEMBL866696 | 0.70 | — | — | |
| SCHEMBL16149189 | 0.69 | CA12 (0.31) | — | |
| SCHEMBL9809435 | 0.67 | — | — | |
| SCHEMBL6740181 | 0.64 | — | — | |
| SCHEMBL2715230 | 0.64 | TP53 (0.41) | — | |
| SCHEMBL6740184 | 0.64 | — | — | |
| SCHEMBL10418342 | 0.63 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0492128-B1 | Triazine compounds and method for dyeing or printing fiber materials using the same | SUMITOMO CHEMICAL CO (JP) | 1997-06-04 | — | — | EP | disclosed |
| US-5235046-A | Colorfast, washfast | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1993-08-10 | — | — | US | disclosed |
| EP-0492128-A1 | Triazine compounds and method for dyeing or printing fiber materials using the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1992-07-01 | — | — | EP | disclosed |