⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24331064 | 0.77 | — | — | |
| SCHEMBL726571 | 0.77 | — | — | |
| SCHEMBL17061030 | 0.77 | — | — | |
| SCHEMBL13296092 | 0.76 | — | — | |
| SCHEMBL18569972 | 0.76 | — | — | |
| SCHEMBL16944029 | 0.73 | — | — | |
| SCHEMBL15759329 | 0.71 | TSHR (0.35) | — | |
| SCHEMBL15402893 | 0.71 | — | — | |
| SCHEMBL25107076 | 0.71 | — | — | |
| SCHEMBL6410247 | 0.69 | — | — |
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 |
| CN-103347855-A | Method for preparing thiocarboxylic acid s-(fluoroalkyl) ester | SUMITOMO CHEMICAL CO | 2013-10-09 | — | — | CN | disclosed |
| CN-101983417-B | Plasma etching method | ZEON CORP | 2013-04-24 | — | — | CN | disclosed |
| US-20110068086-A1 | PLASMA ETCHING METHOD | ZEON CORPORATION (JP) | 2011-03-24 | — | — | US | disclosed |
| CN-101983417-A | Plasma etching method | ZEON CORP | 2011-03-02 | — | — | CN | disclosed |
| US-5254755-A | Solvents, cleaning compounds | ALLIED-SIGNAL INC. (US) | 1993-10-19 | — | — | US | disclosed |
| WO-1992010454-A1 | PARTIALLY FLUORINATED ALKANOLS HAVING A TERTIARY STRUCTURE | ALLIED-SIGNAL INC. (US) | 1992-06-25 | — | — | WO | disclosed |