⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29687961 | 0.78 | — | — | |
| SCHEMBL157908 | 0.78 | — | — | |
| SCHEMBL8663534 | 0.77 | LMNA (0.53) | — | |
| SCHEMBL31482338 | 0.77 | LMNA (0.53) | — | |
| SCHEMBL31498989 | 0.77 | TSHR (0.60) | — | |
| SCHEMBL1686517 | 0.77 | TSHR (0.60) | — | |
| SCHEMBL1272337 | 0.75 | KMT2A (0.70) | — | |
| SCHEMBL11556917 | 0.74 | — | — | |
| SCHEMBL9311985 | 0.74 | KMT2A (0.75) | — | |
| SCHEMBL8556893 | 0.73 | KMT2A (0.77) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9447201-B2 | Polymerization inhibitor composition and method of inhibiting polymerization of distillable monomers | DOW GLOBAL TECHNOLOGIES LLC (US) | 2016-09-20 | — | — | US | disclosed |
| EP-2398832-B1 | POLYMERIZATION INHIBITOR COMPOSITION AND METHOD OF INHIBITING POLYMERIZATION OF DISTILLABLE MONOMERS | DOW GLOBAL TECHNOLOGIES LLC (US) | 2014-03-26 | — | — | EP | disclosed |
| EP-2398832-A1 | POLYMERIZATION INHIBITOR COMPOSITION AND METHOD OF INHIBITING POLYMERIZATION OF DISTILLABLE MONOMERS | Dow Global Technologies LLC (US) | 2011-12-28 | — | — | EP | disclosed |
| US-20110290635-A1 | POLYMERIZATION INHIBITOR COMPOSITION AND METHOD OF INHIBITING POLYMERIZATION OF DISTILLABLE MONOMERS | CARNEGIE MELLON UNIVERSITY | 2011-12-01 | — | — | US | disclosed |
| WO-2010096512-A1 | POLYMERIZATION INHIBITOR COMPOSITION AND METHOD OF INHIBITING POLYMERIZATION OF DISTILLABLE MONOMERS | DOW GLOBAL TECHNOLOGIES INC. (US) | 2010-08-26 | — | — | WO | disclosed |
| US-5495045-A | REACTING ALKOXYALKANOL WITH STABLE FREE RADICAL NITROXIDE IN PRESENCE OF CERIUM SALT, NITRITE COMPOUND, POLAR SOLVENT, OXIDANT AND WATER | SHELL OIL COMPANY (US) | 1996-02-27 | — | — | US | disclosed |
| US-5352824-A | Oxidation of alkoxyalkanol using stable free radical nitroxide, copper or iron salt and nitrite catalysts in solvent | SHELL OIL COMPANY (US) | 1994-10-04 | — | — | US | disclosed |
| US-5336811-A | Reacting corresponding aryl methanol with a free radical nitroxide in the presence of a nitrogen oxide generating compound | SHELL OIL COMPANY (US) | 1994-08-09 | — | — | US | disclosed |