⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26253 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL11086551 | 0.94 | — | — | |
| Hydrogen Sulfide SCHEMBL10802332 | 0.94 | — | — | |
| Urea SCHEMBL5996627 | 0.94 | — | — | |
| SCHEMBL4294610 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL1437503 | 0.94 | — | — | |
| SCHEMBL10436508 | 0.94 | — | — | |
| Hydrogen Sulfide SCHEMBL4798139 | 0.94 | — | — | |
| Bromide SCHEMBL20920200 | 0.94 | LMNA (0.50) | — | |
| SCHEMBL14674628 | 0.94 | LMNA (0.50) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20190055470-A1 | HYDROPHOBIC-HYDROPHILIC SWITCHABLE POLYMERS FOR USE IN AGRICULTURE | COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) | 2019-02-21 | — | — | US | disclosed |
| WO-2017161418-A1 | HYDROPHOBIC-HYDROPHILIC SWITCHABLE POLYMERS FOR USE IN AGRICULTURE | COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) | 2017-09-28 | — | — | WO | disclosed |
| US-5922654-A | TWO OR MORE ORGANOMETALLIC COMPOUNDS WHERE THE METAL IS A TRANSITION METAL OR SEMIMETAL, OR ZINC; FOR EXAMPLE, ZINC DIALKYLDITHIOPHOSPHATE, OR NICKEL DIALKYLDITHIOCARBAMATE; HIGHER LOAD BEARING PROPERTIES, HIGH TEMPERATURE PERFORMANCE | NSK LTD. (JP) | 1999-07-13 | — | — | US | disclosed |