⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3864019 | 1.00 | — | — | |
| SCHEMBL7046631 | 1.00 | — | — | |
| SCHEMBL9812361 | 0.79 | — | — | |
| SCHEMBL10661623 | 0.76 | FFAR3 (0.55) | — | |
| SCHEMBL10661655 | 0.76 | FFAR3 (0.55) | — | |
| SCHEMBL141678 | 0.76 | FFAR3 (0.55) | — | |
| SCHEMBL105998 | 0.76 | FFAR3 (0.55) | — | |
| SCHEMBL105999 | 0.76 | FFAR3 (0.55) | — | |
| SCHEMBL9306774 | 0.76 | FFAR3 (0.38) | — | |
| SCHEMBL8081158 | 0.76 | FFAR3 (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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9018255-B2 | Esters of (acyloxymethyl)acrylamide, a pharmaceutical composition containing them, and their use as inhibitors of the thioredoxin—thioredoxin reductase system | Instytut Chemii Organicznej Polskiej Akademii Nauk (PL) | 2015-04-28 | — | — | US | disclosed |
| EP-2627628-B1 | NOVEL ESTERS OF (ACYLOXYMETHYL)ACRYLAMIDE, A PHARMACEUTICAL COMPOSITION CONTAINING THEM, AND THEIR USE AS INHIBITORS OF THE THIOREDOXIN - THIOREDOXIN REDUCTASE SYSTEM | INST CHEMII ORGANICZNEJ POLSKIEJ AKADEMII NAUK (PL) | 2015-04-15 | — | — | EP | disclosed |
| US-20130317102-A1 | Novel Esters of (Acyloxymethyl)Acrylamide, a Pharmaceutical Composition Containing Them, and Their use as Inhibitors of the Thioredoxin - Thioredoxin Reductase System | Instytut Chemii Organicznej Polskiej Akademii Nauk (PL) | 2013-11-28 | — | — | US | disclosed |
| EP-2627628-A1 | NOVEL ESTERS OF (ACYLOXYMETHYL)ACRYLAMIDE, A PHARMACEUTICAL COMPOSITION CONTAINING THEM, AND THEIR USE AS INHIBITORS OF THE THIOREDOXIN - THIOREDOXIN REDUCTASE SYSTEM | Instytut Chemii Fizycznej Polskiej Akademii Nauk (PL) | 2013-08-21 | — | — | EP | disclosed |
| WO-2012050465-A1 | NOVEL ESTERS OF (ACYLOXYMETHYL)ACRYLAMIDE, A PHARMACEUTICAL COMPOSITION CONTAINING THEM, AND THEIR USE AS INHIBITORS OF THE THIOREDOXIN - THIOREDOXIN REDUCTASE SYSTEM | Instytut Chemii Organicznej Polskiej Akademii Nauk (PL) | 2012-04-19 | — | — | WO | disclosed |
| EP-2227501-A1 | POLYMER CARBON NANOTUBE COMPOSITES | Nanoledge Inc. (CA) | 2010-09-15 | — | — | EP | disclosed |
| WO-2009065225-A1 | POLYMER CARBON NANOTUBE COMPOSITES | NANOLEDGE INC. (CA) | 2009-05-28 | — | — | WO | disclosed |
| EP-0011116-B1 | PROCESS FOR THE PREPARATION OF A LIQUID MIXTURE OF ACRYL AMIDE AND QUATERNIZED AMINOALKYL ESTERS OR AMINOALKYL AMIDES OF ACRYLIC OR METHACRYLIC ACID | RÖHM GMBH (DE) | 1982-02-03 | — | — | EP | disclosed |
| US-4128554-A | Process for the preparation of carboxylic acid amides from organic halides | UNIVERSITY OF DELAWARE (US) | 1978-12-05 | — | — | US | disclosed |