⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9504230 | 0.84 | ALDH1A1 (0.58) | — | |
| SCHEMBL6414229 | 0.83 | HCAR2 (0.43) | — | |
| SCHEMBL2866836 | 0.83 | HCAR2 (0.43) | — | |
| SCHEMBL8636453 | 0.83 | HCAR2 (0.43) | — | |
| SCHEMBL6670943 | 0.83 | HCAR2 (0.43) | — | |
| SCHEMBL14672059 | 0.83 | HCAR2 (0.43) | — | |
| SCHEMBL29832137 | 0.81 | — | — | |
| SCHEMBL6210768 | 0.81 | — | — | |
| SCHEMBL29387028 | 0.81 | HSD17B10 (0.42) | — | |
| SCHEMBL27458 | 0.81 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1189836-B1 | METHOD FOR STABILIZING HYDROGEN PEROXIDE | DSM FINE CHEM AUSTRIA GMBH (AT) | 2004-03-03 | — | — | EP | disclosed |
| EP-1140769-B1 | METHOD FOR PRODUCING GLYOXYLIC ACID ESTERS OR THE HYDRATES THEREOF | DSM FINE CHEM AUSTRIA GMBH (AT) | 2003-05-14 | — | — | EP | disclosed |
| EP-1189836-A1 | METHOD FOR STABILIZING HYDROGEN PEROXIDE | DSM Fine Chemicals Austria Nfg GmbH & Co KG (AT) | 2002-03-27 | — | — | EP | disclosed |
| EP-1140769-A1 | METHOD FOR PRODUCING GLYOXYLIC ACID ESTERS OR THE HYDRATES THEREOF | DSM Fine Chemicals Austria Nfg GmbH & Co KG (AT) | 2001-10-10 | — | — | EP | disclosed |
| WO-2001002293-A1 | METHOD FOR STABILIZING HYDROGEN PEROXIDE | DSM FINE CHEMICALS AUSTRIA NFG GMBH & COKG (AT) | 2001-01-11 | — | — | WO | disclosed |
| WO-2000039068-A1 | METHOD FOR PRODUCING GLYOXYLIC ACID ESTERS OR THE HYDRATES THEREOF | DSM FINE CHEMICALS AUSTRIA GMBH (AT) | 2000-07-06 | — | — | WO | disclosed |
| EP-0401533-B1 | CONTINUOUS PROCESS FOR THE PREPARATION OF GLYOXYLIC ACID | Chemie Linz Gesellschaft m.b.H. (AT) | 1993-06-30 | — | — | EP | disclosed |
| EP-0401533-A1 | Continuous process for the preparation of glyoxylic acid | Chemie Linz Gesellschaft m.b.H. (AT) | 1990-12-12 | — | — | EP | disclosed |