⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL216315 | 0.79 | — | — | |
| SCHEMBL11708331 | 0.73 | ALDH1A1 (0.37) | — | |
| SCHEMBL161848 | 0.70 | — | — | |
| SCHEMBL27750983 | 0.69 | CES1 (0.40) | — | |
| SCHEMBL8641529 | 0.65 | SMPD1 (0.32) | — | |
| SCHEMBL19136740 | 0.65 | ALDH1A1 (0.38) | — | |
| SCHEMBL16622882 | 0.64 | — | — | |
| SCHEMBL10397171 | 0.63 | TSHR (0.36) | — | |
| SCHEMBL2181225 | 0.63 | ALDH1A1 (0.33) | — | |
| SCHEMBL9630187 | 0.62 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2285917-A1 | FIXER INKS FOR USE WITH INK JET INKS | E. I. du Pont de Nemours and Company (US) | 2011-02-23 | — | — | EP | disclosed |
| WO-2011008820-A1 | METHOD OF PRINTING USING INK JET INKS COMPRISING A CROSSLINKING PIGMENT DISPERSION BASED ON DIBLOCK POLYMERIC DISPERSANTS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2011-01-20 | — | — | WO | disclosed |
| WO-2009143233-A1 | FIXER INKS FOR USE WITH INK JET INKS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2009-11-26 | — | — | WO | disclosed |
| WO-2009137747-A1 | INKJET INKS CONTAINING CROSSLINKED POLYURETHANES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2009-11-12 | — | — | WO | disclosed |
| EP-1789506-A1 | IR TRANSPARENT CYAN INKJET INK | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2007-05-30 | — | — | EP | disclosed |
| WO-2006028909-A1 | IR TRANSPARENT CYAN INKJET INK | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2006-03-16 | — | — | WO | disclosed |