⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL5367058 | 0.97 | ALDH1A1 (0.43) | — | |
| SCHEMBL465284 | 0.97 | — | — | |
| SCHEMBL4660163 | 0.95 | — | — | |
| SCHEMBL23834439 | 0.95 | — | — | |
| SCHEMBL7598902 | 0.78 | — | — | |
| SCHEMBL4349103 | 0.77 | — | — | |
| SCHEMBL10975756 | 0.77 | CA12 (0.40) | — | |
| SCHEMBL10377381 | 0.77 | — | — | |
| SCHEMBL4349098 | 0.77 | — | — | |
| SCHEMBL17520266 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116818743-A | Technology for detecting inorganic explosive perchlorate based on surface enhanced Raman scattering | 广西三环高科拉曼芯片技术有限公司 | 2023-09-29 | — | — | CN | claimed |
| WO-2020113964-A1 | METHOD FOR PREPARING NANO CALCIUM CARBONATE FOR ENHANCING YIELD OF PVC AUTOMOBILE PRIMER COATING | 东北大学 | 2020-06-11 | — | — | WO | claimed |
| CN-116818743-A | Technology for detecting inorganic explosive perchlorate based on surface enhanced Raman scattering | 广西三环高科拉曼芯片技术有限公司 | 2023-09-29 | — | — | CN | disclosed |
| CN-110563622-A | Synthetic method of mixed heavy metal capture agent | 南通乐尔环保科技有限公司 | 2019-12-13 | — | — | CN | disclosed |
| CN-101259191-B | Fat-reducing health products and producing method thereof | NANNING SINOZYME BIOTECHNOLOGY CO LTD | 2010-12-29 | — | — | CN | disclosed |
| CN-101259191-A | Fat-reducing health products and producing method thereof | NANNING SINOZYME BIOTECHNOLOGY (CN) | 2008-09-10 | — | — | CN | disclosed |
| WO-2007084839-A2 | DIETARY METHODS AND COMPOSITIONS FOR ENHANCING METABOLISM AND REDUCTING REACTIVE OXYGEN SPECIES | ELIXIRIN CORPORATION (US) | 2007-07-26 | — | — | WO | disclosed |
| US-4008259-A | AGRICULTURAL GERMICIDE | YONEZAWA CHEMICAL IND. CO., LTD. (JA) | 1977-02-15 | — | — | US | disclosed |