⚠ 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 | |
|---|---|---|---|---|
| Arsenic SCHEMBL28133753 | 0.89 | — | — | |
| Arsenic SCHEMBL15993633 | 0.87 | — | — | |
| SCHEMBL28026129 | 0.87 | — | — | |
| Arsenic SCHEMBL27587789 | 0.87 | — | — | |
| Arsenic SCHEMBL27829152 | 0.87 | — | — | |
| Arsenic SCHEMBL28110596 | 0.82 | — | — | |
| Arsenic SCHEMBL28960366 | 0.76 | — | — | |
| Arsenic SCHEMBL28875534 | 0.75 | — | — | |
| Arsenic SCHEMBL28548652 | 0.75 | — | — | |
| Arsenic SCHEMBL27605678 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108226275-A | A kind of method of 33 kinds of elements while Accurate Determining in soil | 鹤壁市疾病预防控制中心 | 2018-06-29 | — | — | CN | disclosed |
| CN-106680358-A | Inductively coupled plasma mass spectrometry method for determining content of chrome, arsenic, cadmium and lead in soil | 江苏中宜金大分析检测有限公司 | 2017-05-17 | — | — | CN | disclosed |
| CN-105866449-A | On-line multi-parameter water heavy metal monitoring method | 三峡大学 | 2016-08-17 | — | — | CN | disclosed |
| CN-105842467-A | Water quality multi-parameter online monitoring apparatus | 三峡大学 | 2016-08-10 | — | — | CN | disclosed |