⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11516983 | 0.80 | — | — | |
| SCHEMBL2514973 | 0.80 | — | — | |
| SCHEMBL7054206 | 0.80 | — | — | |
| SCHEMBL2238110 | 0.77 | — | — | |
| SCHEMBL6561536 | 0.77 | — | — | |
| SCHEMBL1866882 | 0.77 | — | — | |
| SCHEMBL26197583 | 0.77 | — | — | |
| SCHEMBL13585547 | 0.77 | — | — | |
| SCHEMBL447922 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL1695330 | 0.77 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1329487-B1 | Use of aqueous ink-jet inks for printing on commercial offset coated media | HEWLETT PACKARD CO (US) | 2006-11-22 | — | — | EP | claimed |
| EP-0953612-B1 | Yellow ink for ink jet printing | XEROX CORP (US) | 2004-05-06 | — | — | EP | claimed |
| EP-0602914-B1 | Ink compositions for ink jet printing | XEROX CORP (US) | 1997-11-12 | — | — | EP | claimed |