⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27641239 | 0.98 | — | — | |
| SCHEMBL27639984 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL27474420 | 0.68 | — | — | |
| SCHEMBL28325891 | 0.67 | ALDH1A1 (0.31) | — | |
| SCHEMBL27446643 | 0.60 | — | — | |
| SCHEMBL27682991 | 0.58 | — | — | |
| SCHEMBL27438672 | 0.58 | — | — | |
| SCHEMBL27480035 | 0.56 | — | — | |
| SCHEMBL10666354 | 0.56 | — | — | |
| SCHEMBL27486976 | 0.55 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115486451-A | Long-acting slow-release antibacterial mildew inhibitor | 广州市宝绅科技应用有限公司 | 2022-12-20 | — | — | CN | claimed |
| CN-1280213-C | Multifunctional water-treating composition and method of water-treating using the same | SK CHEMICALS CO LTD (KR) | 2006-10-18 | — | — | CN | claimed |
| CN-1473137-A | Multifunctional water-treating composition and method of water-treating using the same | SK化学株式会社 | 2004-02-04 | — | — | CN | claimed |
| CN-115486451-A | Long-acting slow-release antibacterial mildew inhibitor | 广州市宝绅科技应用有限公司 | 2022-12-20 | — | — | CN | disclosed |
| CN-115486451-A | Long-acting slow-release antibacterial mildew inhibitor | 广州市宝绅科技应用有限公司 | 2022-12-20 | — | — | CN | disclosed |
| CN-105307689-A | Compressed gas aerosol composition in steel can | JOHNSON & SON INC S C | 2016-02-03 | — | — | CN | disclosed |
| CN-100565813-C | Aqueous dispersion for chemical mechanical polishing and chemical and mechanical grinding method and the kit that is used to modulate aqueous dispersion for chemical mechanical polishing | JSR CORP (JP) | 2009-12-02 | — | — | CN | disclosed |
| CN-101331593-A | Aqueous dispersion for chemical mechanical polishing, chemical mechanical polishing method, and kit for preparing aqueous dispersion for chemical mechanical polishing | JSR CORP (JP) | 2008-12-24 | — | — | CN | disclosed |
| CN-1280213-C | Multifunctional water-treating composition and method of water-treating using the same | SK CHEMICALS CO LTD (KR) | 2006-10-18 | — | — | CN | disclosed |
| CN-1473137-A | Multifunctional water-treating composition and method of water-treating using the same | SK化学株式会社 | 2004-02-04 | — | — | CN | disclosed |