⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14004304 | 1.00 | — | — | |
| SCHEMBL14004302 | 0.94 | — | — | |
| SCHEMBL14030065 | 0.91 | — | — | |
| SCHEMBL14030067 | 0.91 | — | — | |
| SCHEMBL14004303 | 0.88 | — | — | |
| SCHEMBL14004301 | 0.86 | — | — | |
| SCHEMBL14004300 | 0.86 | — | — | |
| SCHEMBL14004310 | 0.82 | — | — | |
| SCHEMBL14004312 | 0.82 | — | — | |
| SCHEMBL14004298 | 0.81 | CD40 (0.38) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080289124-A1 | Reactive Azo Dyes, Methods for the Production Thereof and Their Use | DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) | 2008-11-27 | — | — | US | disclosed |
| WO-2007006594-A2 | REACTIVE AZO DYES, METHODS FOR THE PRODUCTION THEREOF AND THEIR USE | DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) | 2007-01-18 | — | — | WO | disclosed |