⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4429155 | 0.78 | — | — | |
| SCHEMBL4425593 | 0.76 | — | — | |
| SCHEMBL4271384 | 0.76 | — | — | |
| SCHEMBL4425591 | 0.76 | — | — | |
| SCHEMBL4430806 | 0.72 | — | — | |
| SCHEMBL4015699 | 0.71 | — | — | |
| SCHEMBL1476729 | 0.70 | APEX1 (0.34) | — | |
| SCHEMBL21828782 | 0.69 | KDM4E (0.32) | — | |
| SCHEMBL1427399 | 0.68 | TSHR (0.33) | — | |
| SCHEMBL6355165 | 0.67 | ALDH1A1 (0.33) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8641182-B2 | Ink jet ink, ink cartridge, and ink jet recording method | CANON KABUSHIKI KAISHA (JP) | 2014-02-04 | — | — | US | disclosed |
| US-8622536-B2 | Ink jet aqueous ink, ink cartridge, and ink jet recording method | CANON KABUSHIKI KAISHA (JP) | 2014-01-07 | — | — | US | disclosed |
| US-8439495-B2 | Ink jet liquid composition, set, liquid cartridge, and ink jet recording method | CANON KABUSHIKI KAISHA (JP) | 2013-05-14 | — | — | US | disclosed |
| EP-2423271-B1 | Ink jet liquid composition, set, liquid cartridge, and ink jet recording method | CANON KK (JP) | 2012-12-19 | — | — | EP | disclosed |
| US-20120050391-A1 | INK JET LIQUID COMPOSITION, SET, LIQUID CARTRIDGE, AND INK JET RECORDING METHOD | CANON KABUSHIKI KAISHA (JP) | 2012-03-01 | — | — | US | disclosed |
| US-20120050388-A1 | INK JET AQUEOUS INK, INK CARTRIDGE, AND INK JET RECORDING METHOD | CANON KABUSHIKI KAISHA (JP) | 2012-03-01 | — | — | US | disclosed |
| US-20120050384-A1 | INK JET INK, INK CARTRIDGE, AND INK JET RECORDING METHOD | CANON KABUSHIKI KAISHA (JP) | 2012-03-01 | — | — | US | disclosed |
| EP-2423272-A2 | Ink jet aqueous ink, ink cartridge, and ink jet recording method | Canon Kabushiki Kaisha (JP) | 2012-02-29 | — | — | EP | disclosed |
| EP-2423273-A1 | Ink jet ink containing an ABC triblock copolymer | Canon Kabushiki Kaisha (JP) | 2012-02-29 | — | — | EP | disclosed |
| EP-2423271-A1 | Ink jet liquid composition, set, liquid cartridge, and ink jet recording method | Canon Kabushiki Kaisha (JP) | 2012-02-29 | — | — | EP | disclosed |