⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL505953 | 0.87 | — | — | |
| SCHEMBL6223633 | 0.87 | — | — | |
| Sulfuric Acid SCHEMBL27311595 | 0.80 | CA5A (0.43) | — | |
| Formaldehyde SCHEMBL9014350 | 0.80 | APEX1 (0.38) | — | |
| SCHEMBL11139493 | 0.78 | APEX1 (0.36) | — | |
| SCHEMBL11687102 | 0.78 | APEX1 (0.36) | — | |
| SCHEMBL8471650 | 0.75 | CA2 (0.37) | — | |
| SCHEMBL28957411 | 0.75 | CA2 (0.37) | — | |
| SCHEMBL20747223 | 0.73 | — | — | |
| SCHEMBL5827456 | 0.73 | CA2 (0.32) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6146430-A | Asymmetric dioxazine compound and method for dyeing or printing fiber Material using the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-11-14 | — | — | US | claimed |
| US-6146430-A | Asymmetric dioxazine compound and method for dyeing or printing fiber Material using the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-11-14 | — | — | US | disclosed |
| US-5977358-A | Asymmetric dioxazine compounds, intermediate compounds therefor and application of the asymmetric dioxazine compounds | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1999-11-02 | — | — | US | disclosed |
| US-5837869-A | CHLORINE-FAST DYE | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1998-11-17 | — | — | US | disclosed |