⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2261438 | 0.60 | — | — | |
| SCHEMBL6562332 | 0.52 | — | — | |
| Calcium Chloride SCHEMBL26676216 | 0.43 | — | — | |
| Calcium Chloride SCHEMBL5381230 | 0.43 | — | — | |
| 1,4-Dichlorobenzene SCHEMBL5191 | 0.41 | — | — | |
| SCHEMBL348913 | 0.41 | AHR (0.67) | — | |
| SCHEMBL7079561 | 0.41 | — | — | |
| SCHEMBL20781 | 0.41 | — | — | |
| Calcium Chloride SCHEMBL23441478 | 0.39 | — | — | |
| Calcium Chloride SCHEMBL25175017 | 0.39 | — | — |
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-0728730-B1 | Process for preparing monochloroacetic acid | SALZGITTER ANLAGENBAU GMBH (DE) | 2001-03-07 | — | — | EP | disclosed |
| EP-0728730-A1 | Process for preparing monochloroacetic acid | Salzgitter Anlagenbau Zweigniederlassung der Preussag Anlagenbau GmbH (DE) | 1996-08-28 | — | — | EP | disclosed |
| EP-0392037-A1 | Process for the preparation of syn-aminothiazolyl and syn-amino-oxazolyl derivatives of alkoxyiminoacetic acids | TECHNOLOGITCHEN KOMBINAT ZA PROMISHLENA MIKROBIOLOGIA (BG) | 1990-10-17 | — | — | EP | disclosed |