⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8539928 | 0.86 | — | — | |
| SCHEMBL2134527 | 0.86 | — | — | |
| SCHEMBL23986554 | 0.86 | — | — | |
| SCHEMBL15403336 | 0.81 | TSHR (0.39) | — | |
| SCHEMBL55744 | 0.78 | — | — | |
| SCHEMBL2134525 | 0.78 | — | — | |
| SCHEMBL1454894 | 0.76 | — | — | |
| Ammonia Solution, Strong SCHEMBL3112805 | 0.76 | — | — | |
| SCHEMBL9634008 | 0.76 | — | — | |
| SCHEMBL7646985 | 0.76 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2684870-A1 | METHOD FOR PREPARING THIOCARBOXYLIC ACID S-(FLUOROALKYL) ESTER | Sumitomo Chemical Company Limited (JP) | 2014-01-15 | — | — | EP | disclosed |
| EP-2664613-A1 | Process for producing amide compounds | Sumitomo Chemical Company, Limited (JP) | 2013-11-20 | — | — | EP | disclosed |
| EP-2662355-A1 | Process for producing a (fluoroalkylthio) acetonitrile | Sumitomo Chemical Company, Limited (JP) | 2013-11-13 | — | — | EP | disclosed |
| CN-103347855-A | Method for preparing thiocarboxylic acid s-(fluoroalkyl) ester | SUMITOMO CHEMICAL CO | 2013-10-09 | — | — | CN | disclosed |
| EP-2465846-A1 | PROCESS FOR PREPARATION OF (FLUOROALKYLTHIO)ACETIC ACID ESTERS | Sumitomo Chemical Company, Limited (JP) | 2012-06-20 | — | — | EP | disclosed |
| CN-102471252-A | Process for producing (fluoroalkylthio) acetic acid ester | SUMITOMO CHEMICAL CO | 2012-05-23 | — | — | CN | disclosed |
| US-20120101294-A1 | PROCESS FOR PRODUCING (FLUOROALKYLTHIO) ACETIC ACID ESTER | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-04-26 | — | — | US | disclosed |