⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6329929 | 0.73 | — | — | |
| SCHEMBL18328018 | 0.69 | — | — | |
| SCHEMBL718438 | 0.69 | — | — | |
| SCHEMBL10598123 | 0.67 | — | — | |
| SCHEMBL20483427 | 0.67 | — | — | |
| SCHEMBL7522816 | 0.67 | — | — | |
| SCHEMBL8650 | 0.67 | — | — | |
| SCHEMBL4327866 | 0.67 | — | — | |
| SCHEMBL948116 | 0.67 | — | — | |
| SCHEMBL7517028 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9296700-B2 | Method for purifying a pyrazolinone derivative | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2016-03-29 | — | — | US | disclosed |
| EP-2441756-B1 | METHOD FOR PURIFYING A PYRAZOLINONE DERIVATIVE | SUMITOMO CHEMICAL CO (JP) | 2014-05-14 | — | — | EP | disclosed |
| CN-102459190-A | Method for purifying pyrazolone derivative | SUMITOMO CHEMICAL CO | 2012-05-16 | — | — | CN | disclosed |
| EP-2441756-A1 | METHOD FOR PURIFYING A PYRAZOLINONE DERIVATIVE | Sumitomo Chemical Company, Limited (JP) | 2012-04-18 | — | — | EP | disclosed |
| US-20120071666-A1 | Method for Purifying a Pyrazolinone Derivative | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-03-22 | — | — | US | disclosed |
| EP-1121337-B1 | PREPARATION OF CYCLOPROPYLETHYNE AND INTERMEDIATES FOR PREPARATION OF CYCLOPROPYLETHYNE | GREAT LAKES UK LTD (GB) | 2003-04-09 | — | — | EP | disclosed |
| US-6528693-B1 | Treating 1-cyclopropylethanone with base and dichlorotriaryl-or trialkylphosphorane; dehydrochlorination | GREAT LAKES (UK) LIMITED (GB) | 2003-03-04 | — | — | US | disclosed |
| EP-1121337-A1 | PREPARATION OF CYCLOPROPYLETHYNE AND INTERMEDIATES FOR PREPARATION OF CYCLOPROPYLETHYNE | GREAT LAKES (UK) LIMITED (GB) | 2001-08-08 | — | — | EP | disclosed |
| WO-2000021912-A1 | PREPARATION OF CYCLOPROPYLETHYNE AND INTERMEDIATES FOR PREPARATION OF CYCLOPROPYLETHYNE | GREAT LAKES (UK) LIMITED (GB) | 2000-04-20 | — | — | WO | disclosed |