⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL9788488 | 0.87 | — | — | |
| Fluoride SCHEMBL2240364 | 0.87 | — | — | |
| Fluoride SCHEMBL118512 | 0.87 | — | — | |
| Fluoride SCHEMBL3277312 | 0.87 | — | — | |
| Fluoride SCHEMBL9788487 | 0.87 | — | — | |
| SCHEMBL7201746 | 0.87 | — | — | |
| SCHEMBL4727366 | 0.87 | — | — | |
| SCHEMBL29203920 | 0.87 | — | — | |
| Fluoride SCHEMBL3277308 | 0.87 | — | — | |
| SCHEMBL5852872 | 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-105540939-A | Device and method for removing calcium, magnesium, fluorine and silicon elements in wastewater | BEIJING WOTEER WATER TECH CO LTD | 2016-05-04 | — | — | CN | claimed |
| CN-115784530-A | Coal gasification black ash water treatment and reuse emission reduction technical method | 苏州永峰联环保科技有限公司 | 2023-03-14 | — | — | CN | disclosed |
| CN-218146261-U | Zero release industrial water processing system of carbon neutralization | 哈尔滨工业大学（深圳） | 2022-12-27 | — | — | CN | disclosed |
| CN-105540939-A | Device and method for removing calcium, magnesium, fluorine and silicon elements in wastewater | BEIJING WOTEER WATER TECH CO LTD | 2016-05-04 | — | — | CN | disclosed |