⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13456089 | 0.88 | FUT8 (0.38) | — | |
| SCHEMBL13425429 | 0.82 | — | — | |
| SCHEMBL13425432 | 0.82 | FUT8 (0.35) | — | |
| SCHEMBL13456085 | 0.75 | ENPP2 (0.39) | — | |
| SCHEMBL13456086 | 0.74 | ENPP2 (0.37) | — | |
| SCHEMBL13425414 | 0.72 | BRD4 (0.33) | — | |
| SCHEMBL13425415 | 0.72 | ENPP2 (0.36) | — | |
| SCHEMBL13425411 | 0.70 | PRMT3 (0.39) | — | |
| SCHEMBL13425384 | 0.69 | PTPN11 (0.42) | — | |
| SCHEMBL13425385 | 0.68 | P2RX3 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100068472-A1 | Yellow Azo Dyes for Ink Jet Printing | FUJIFILM IMAGING COLORANTS LIMITED (GB) | 2010-03-18 | — | — | US | disclosed |