⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13727790 | 0.93 | — | — | |
| Methane SCHEMBL16863054 | 0.86 | — | — | |
| SCHEMBL17140369 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL18553832 | 0.86 | — | — | |
| SCHEMBL16534492 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL15063238 | 0.86 | — | — | |
| SCHEMBL14861272 | 0.72 | — | — | |
| Chloroform SCHEMBL16678499 | 0.72 | — | — | |
| SCHEMBL28028761 | 0.68 | — | — | |
| Carbamic Acid SCHEMBL14360372 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10501762-B2 | Methods and systems for sulfimidation or sulfoximidation of organic molecules | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2019-12-10 | — | — | US | disclosed |
| US-20160355852-A1 | METHODS AND SYSTEMS FOR SULFIMIDATION OR SULFOXIMIDATION OF ORGANIC MOLECULES | THE CALIFORNIA INSTITUTE OF TECHNOLOGY | 2016-12-08 | — | — | US | disclosed |
| US-9399762-B2 | Methods and systems for sulfimidation or sulfoximidation of organic molecules | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2016-07-26 | — | — | US | disclosed |
| US-20150232814-A1 | METHODS AND SYSTEMS FOR SULFIMIDATION OR SULFOXIMIDATION OF ORGANIC MOLECULES | NAVY, SECRETARY OF THE UNITED STATES OF AMERICA | 2015-08-20 | — | — | US | disclosed |