⚠ 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 | |
|---|---|---|---|---|
| Isothiazole SCHEMBL27356697 | 0.97 | — | — | |
| Isothiazole SCHEMBL5679 | 0.96 | — | — | |
| Isothiazole SCHEMBL642842 | 0.96 | — | — | |
| Isothiazole SCHEMBL27325125 | 0.93 | — | — | |
| Isothiazole SCHEMBL28981301 | 0.93 | — | — | |
| Isothiazole SCHEMBL9391996 | 0.93 | — | — | |
| Isothiazole SCHEMBL2845647 | 0.93 | — | — | |
| Isothiazole SCHEMBL28063961 | 0.93 | — | — | |
| Isothiazole SCHEMBL30450994 | 0.93 | — | — | |
| Isothiazole SCHEMBL28168124 | 0.93 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110305265-A | Anti-settling and thickener composition and the method for using it | 罗地亚经营管理公司 | 2019-10-08 | — | — | CN | disclosed |
| CN-105121480-B | Composition with the pH response polymers containing MAEP and/or MAHP and use its method | 罗地亚经营管理公司 | 2018-01-09 | — | — | CN | disclosed |