⚠ 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 | |
|---|---|---|---|---|
| Acetone SCHEMBL6450237 | 0.94 | — | — | |
| Acetone SCHEMBL15517363 | 0.88 | — | — | |
| Acetone SCHEMBL28828174 | 0.88 | — | — | |
| Acetone SCHEMBL10645016 | 0.88 | — | — | |
| Acetone SCHEMBL11069607 | 0.88 | — | — | |
| Acetone SCHEMBL1907026 | 0.88 | — | — | |
| Acetone SCHEMBL528137 | 0.87 | LMNA (1.00) | — | |
| Acetone SCHEMBL10051943 | 0.87 | — | — | |
| Acetone SCHEMBL5665105 | 0.87 | LMNA (1.00) | — | |
| Acetone SCHEMBL662 | 0.87 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113061437-B | Cadmium-free quantum dot with core-shell structure and preparation method thereof, water-soluble quantum dot and fluorescence labeling reagent | 苏州星烁纳米科技有限公司 | 2023-03-31 | — | — | CN | disclosed |
| CN-113061437-A | Cadmium-free quantum dot with core-shell structure and preparation method thereof, water-soluble quantum dot and fluorescence labeling reagent | 苏州星烁纳米科技有限公司 | 2021-07-02 | — | — | CN | disclosed |
| CN-101784510-B | Dehydration method of hexafluoroacetone hydrate | CENTRAL GLASS CO LTD | 2013-03-20 | — | — | CN | disclosed |
| CN-101784510-A | Dehydration method of hexafluoroacetone hydrate | CENTRAL GLASS CO LTD | 2010-07-21 | — | — | CN | disclosed |
| WO-2009028584-A1 | PROCESS FOR DEHYDRATION OF HEXAFLUOROACETONE HYDRATE | CENTRAL GLASS COMPANY, LIMITED (JP) | 2009-03-05 | — | — | WO | disclosed |
| EP-1590382-B1 | IMPROVED TERMINATION AND REDUCED GEL IN HIGH CIS POLYBUTADIENE | FIRESTONE POLYMERS LLC (US) | 2007-11-28 | — | — | EP | disclosed |
| EP-0980878-B1 | Molecular weight regulation of cis-1,4-polybutadiene using carboxylates | BRIDGESTONE CORP (JP) | 2004-02-25 | — | — | EP | disclosed |
| EP-0980878-A1 | Molecular weight regulation of cis-1,4-polybutadiene using carboxylates | Bridgestone Corporation (JP) | 2000-02-23 | — | — | EP | disclosed |
| US-5698643-A | USING COORDINATION CATALYST; TIRES | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1997-12-16 | — | — | US | disclosed |
| US-4983695-A | Catalysis with nickel carboxylate, trialkylaluminum, and hydrogen fluoride ether complex | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1991-01-08 | — | — | US | disclosed |
| EP-0093075-B1 | PREPARATION OF HIGH CIS-1,4-POLYBUTADIENE | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1986-12-30 | — | — | EP | disclosed |
| EP-0093075-A1 | Preparation of high cis-1,4-polybutadiene | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1983-11-02 | — | — | EP | disclosed |
| EP-0093073-A1 | Molecular weight control of polybutadiene | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1983-11-02 | — | — | EP | disclosed |
| EP-0093074-A1 | Controlling the molecular weight of polybutadiene | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1983-11-02 | — | — | EP | disclosed |