⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4887807 | 0.76 | — | — | |
| SCHEMBL26422337 | 0.72 | MEN1 (0.31) | — | |
| SCHEMBL2461587 | 0.72 | — | — | |
| SCHEMBL27630727 | 0.70 | — | — | |
| SCHEMBL184856 | 0.70 | TSHR (0.60) | — | |
| SCHEMBL16776 | 0.69 | — | — | |
| SCHEMBL3166933 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL1275945 | 0.69 | — | — | |
| SCHEMBL28041199 | 0.69 | — | — | |
| SCHEMBL15131440 | 0.68 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8827436-B2 | Fixer inks for use with ink jet inks | E I DU PONT DE NEMOURS AND COMPANY (US) | 2014-09-09 | — | — | US | disclosed |
| US-8546465-B2 | Aqueous ink for inkjet | RISO KAGAKU CORPORATION (JP) | 2013-10-01 | — | — | US | disclosed |
| US-20130027451-A1 | FIXER INKS FOR USE WITH INK JET INKS | E I DUPONT DE NEMOURS AND COMPANY (US) | 2013-01-31 | — | — | US | disclosed |
| WO-2011150301-A1 | FIXER INKS FOR USE WITH INK JET INKS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2011-12-01 | — | — | WO | disclosed |
| CN-101311228-B | Water ink for inking | RISO KAGAKU CORP | 2011-04-13 | — | — | CN | disclosed |
| US-20080293862-A1 | Aqueous ink for inkjet | RISO KAGAKU CORPORATION (JP) | 2008-11-27 | — | — | US | disclosed |
| CN-101311228-A | Water ink for inking | RISO KAGAKU CORP (JP) | 2008-11-26 | — | — | CN | disclosed |