⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL365239 | 0.95 | — | — | |
| Water SCHEMBL8030087 | 0.90 | — | — | |
| Ammonia Solution, Strong SCHEMBL5551020 | 0.90 | — | — | |
| SCHEMBL28474807 | 0.90 | — | — | |
| Butane SCHEMBL9699571 | 0.76 | — | — | |
| SCHEMBL1652664 | 0.70 | — | — | |
| SCHEMBL225685 | 0.70 | — | — | |
| SCHEMBL652266 | 0.67 | — | — | |
| SCHEMBL1310134 | 0.67 | — | — | |
| SCHEMBL3284394 | 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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1972974-B | polymerization process using hydrofluorocarbons | EXXONMOBIL CHEM PATENTS INC | 2010-05-12 | — | — | CN | claimed |
| CN-1972974-A | Polymerization process using hydrofluorocarbons | EXXONMOBIL CHEM PATENTS INC (US) | 2007-05-30 | — | — | CN | claimed |
| CN-113527079-B | Method for preparing 2-isopropenyl-5-methyl-4-hexenoic acid and derivative alcohol and carboxylic ester thereof | 信越化学工业株式会社 | 2023-11-14 | — | — | CN | disclosed |
| CN-109627162-B | Process for preparing (7E) -7, 9-decanedioic acid esters | 信越化学工业株式会社 | 2022-11-15 | — | — | CN | disclosed |
| CN-113527079-A | Method for preparing 2-isopropenyl-5-methyl-4-hexenoic acid and derivative alcohol and carboxylic ester thereof | 信越化学工业株式会社 | 2021-10-22 | — | — | CN | disclosed |
| CN-113527092-A | Process for preparing 6-isopropenyl-3-methyl-9-decenyl acetate and intermediates thereof | 信越化学工业株式会社 | 2021-10-22 | — | — | CN | disclosed |
| CN-101641379-B | Polydispersity-controlled isoolefin polymerization with polymorphogenates | EXXON MOBIL CHEM PATENTS INC | 2012-12-12 | — | — | CN | disclosed |
| CN-101641379-A | Polydispersity-controlled isoolefin polymerization with polymorphogenates | EXXONMOBIL CHEM PATENTS INC US | 2010-02-03 | — | — | CN | disclosed |
| CN-100480284-C | Magnesium halide compositions having improved solubility and catalysts using same | UNIVATION TECH LLC (US) | 2009-04-22 | — | — | CN | disclosed |
| CN-1668657-A | Enhanced solubility of magnesium halides and catalysts and polymerization process using same | UNIVATION TECH LLC (US) | 2005-09-14 | — | — | CN | disclosed |
| CN-1053070-A | The cocatalyst composition that is used for alpha-olefine polymerizing | SOLVAY (BE) | 1991-07-17 | — | — | CN | disclosed |