⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27944581 | 0.85 | — | — | |
| Propane SCHEMBL1470165 | 0.82 | — | — | |
| Ethyl Chloride SCHEMBL473306 | 0.78 | — | — | |
| Butane SCHEMBL1470214 | 0.78 | — | — | |
| Alcohol SCHEMBL28313336 | 0.75 | — | — | |
| Butane SCHEMBL28067260 | 0.75 | FAAH (0.43) | — | |
| Sulfuric Acid SCHEMBL10785154 | 0.75 | — | — | |
| SCHEMBL737387 | 0.73 | — | — | |
| Sulfuric Acid SCHEMBL7606683 | 0.72 | TSHR (0.38) | — | |
| Pentane SCHEMBL21772324 | 0.72 | FAAH (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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111689929-B | Sulfur fluoride (VI) compound and preparation method thereof | 斯克里普斯研究所 | 2024-05-31 | — | — | CN | disclosed |
| CN-117561628-A | Nonaqueous electrolyte, nonaqueous sodium ion battery, nonaqueous potassium ion battery, method for producing nonaqueous sodium ion battery, and method for producing nonaqueous potassium ion battery | 中央硝子株式会社 | 2024-02-13 | — | — | CN | disclosed |
| CN-108475821-A | Cyanoalkyl sulfuryl fluoride for high-performance lithium ion battery group electrolyte composition | 巴斯夫欧洲公司 | 2018-08-31 | — | — | CN | disclosed |
| US-9580444-B2 | Polycyclic pyrazolinone derivative and herbicide comprising same as effective component thereof | SAGAMI CHEMICAL RESEARCH INSTITUTE (JP) | 2017-02-28 | — | — | US | disclosed |
| US-20160024110-A1 | POLYCYCLIC PYRAZOLINONE DERIVATIVE AND HERBICIDE COMPRISING SAME AS EFFECTIVE COMPONENT THEREOF | KAKEN PHARMACEUTICAL CO., LTD. (JP) | 2016-01-28 | — | — | US | disclosed |
| EP-2975040-A1 | POLYCYCLIC PYRAZOLINONE DERIVATIVE AND HERBICIDE COMPRISING SAME AS EFFECTIVE COMPONENT THEREOF | Sagami Chemical Research Institute (JP) | 2016-01-20 | — | — | EP | disclosed |
| US-20110160465-A1 | PRODUCTION METHOD FOR SULTONE DERIVATIVES | KURARAY CO., LTD (JP) | 2011-06-30 | — | — | US | disclosed |
| US-4282144-A | VIOLET TO BLUE DYE SHADES FOR POLYAMIDES | EASTMAN KODAK COMPANY (US) | 1981-08-04 | — | — | US | disclosed |
| US-4265812-A | Azo dyes derived from 3-amino-2,1-benzisothiazoles and aromatic amine couplers containing sulfo groups, or salts thereof | EASTMAN KODAK COMPANY (US) | 1981-05-05 | — | — | US | disclosed |