⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18161623 | 0.78 | — | — | |
| SCHEMBL4480017 | 0.78 | — | — | |
| SCHEMBL4480014 | 0.78 | — | — | |
| SCHEMBL2408997 | 0.77 | — | — | |
| SCHEMBL98033 | 0.74 | — | — | |
| SCHEMBL11841915 | 0.74 | CA2 (0.48) | — | |
| SCHEMBL27455470 | 0.74 | — | — | |
| SCHEMBL25404189 | 0.72 | — | — | |
| SCHEMBL9571020 | 0.72 | — | — | |
| SCHEMBL2220485 | 0.72 | ALDH1A1 (0.50) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023176458-A1 | DISINFECTING COMPOSITION CONTAINING THIAZOLE CARBOXYLIC ACID HYDRAZIDE COMPOUND | 石原産業株式会社 | 2023-09-21 | — | — | WO | disclosed |
| US-20100233415-A1 | OPTICAL RECORDING MEDIUM AND AZO METAL CHELATE COMPOUND | MITSUI CHEMICALS, INC. (JP) | 2010-09-16 | — | — | US | disclosed |
| EP-1997856-A1 | OPTICAL RECORDING MEDIUM AND AZO METAL CHELATE COMPOUND | Mitsui Chemicals, Inc. (JP) | 2008-12-03 | — | — | EP | disclosed |
| EP-0340709-A1 | (3-Chloro-methyl phenyl)ethyl amines, processes for their production and their use | BASF Aktiengesellschaft (DE) | 1989-11-08 | — | — | EP | disclosed |