⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2499215 | 0.96 | ADH1B (0.38) | — | |
| SCHEMBL16240 | 0.96 | — | — | |
| SCHEMBL1330501 | 0.96 | — | — | |
| SCHEMBL10389153 | 0.93 | — | — | |
| Ethane SCHEMBL3680391 | 0.93 | — | — | |
| SCHEMBL8463762 | 0.93 | — | — | |
| Ammonia Solution, Strong SCHEMBL11322135 | 0.93 | — | — | |
| Hydrogen Sulfide SCHEMBL11479835 | 0.93 | — | — | |
| SCHEMBL9570709 | 0.93 | — | — | |
| Methane SCHEMBL9155168 | 0.93 | — | — |
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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8906961-B2 | Glycerol levulinate ketals and their use in the manufacture of polyurethanes, and polyurethanes formed therefrom | SEGETIS, INC. (US) | 2014-12-09 | — | — | US | disclosed |
| EP-1954687-B1 | ADDUCTS OF LEVULINIC DERIVATIVES WITH EPOXIDIZED FATTY ACID ESTERS AND USES THEREOF | SEGETIS INC (US) | 2014-01-08 | — | — | EP | disclosed |
| US-20130303648-A1 | GLYCEROL LEVULINATE KETALS AND THEIR USE IN THE MANUFACTURE OF POLYURETHANES, AND POLYURETHANES FORMED THEREFROM | GFBIOCHEMICALS LIMITED (MT) | 2013-11-14 | — | — | US | disclosed |
| US-20130233204-A1 | ADDUCTS OF LEVULINIC DERIVATIVES WITH EPOXIDIZED FATTY ACID ESTERS AND USES THEREOF | SEGETIS, INC. (US) | 2013-09-12 | — | — | US | disclosed |
| US-8492433-B2 | Glycerol levulinate ketals and their use in the manufacture of polyurethanes, and polyurethanes formed therefrom | SEGETIS, INC. (US) | 2013-07-23 | — | — | US | disclosed |
| EP-1954140-B1 | GLYCEROL LEVULINATE KETALS AND THEIR USE | SEGETIS INC (US) | 2013-05-29 | — | — | EP | disclosed |
| US-8436042-B2 | Adducts of levulinic derivatives with epoxidized fatty acid esters and uses thereof | SEGETIS, INC. (US) | 2013-05-07 | — | — | US | disclosed |
| US-20120196947-A1 | GLYCEROL LEVULINATE KETALS AND THEIR USE IN THE MANUFACTURE OF POLYURETHANES, AND POLYURETHANES FORMED THEREFROM | SEGETIS, INC. (US) | 2012-08-02 | — | — | US | disclosed |
| US-8178701-B2 | Glycerol levulinate ketals and their use | SEGETIS, INC. (US) | 2012-05-15 | — | — | US | disclosed |
| US-20120021962-A1 | GLYCEROL LEVULINATE KETALS AND THEIR USE | SEGETIS, INC. (US) | 2012-01-26 | — | — | US | disclosed |
| WO-2007062118-A2 | GLYCEROL LEVULINATE KETALS AND THEIR USE | AROMAGEN CORPORATION (US) | 2007-05-31 | — | — | WO | disclosed |
| WO-2007062158-A2 | ADDUCTS OF LEVULINIC DERIVATIVES WITH EPOXIDIZED FATTY ACID ESTERS AND USES THEREOF | AROMAGEN CORPORATION (US) | 2007-05-31 | — | — | WO | disclosed |
| EP-0276859-B1 | PREPARATION OF HEXABROMOCYCLODODECANE | DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) | 1990-09-26 | — | — | EP | disclosed |
| US-4783563-A | BROMINATION OF 1,5,9-CYCLODODECATRIENE WITH BORON TRIFLUORIDE COMPLEX CATALYST | DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) | 1988-11-08 | — | — | US | disclosed |
| EP-0276859-A1 | Preparation of hexabromocyclododecane | DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) | 1988-08-03 | — | — | EP | disclosed |
| EP-0107693-B1 | 2,3,4-TRINOR-1,5-INTER-M-PHENYLENE-PROSTACYCLIN-I2 ANALOGUES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) | 1988-07-27 | — | — | EP | disclosed |
| US-4638002-A | ANTIAGGLOMERANTS, HYPOTENSIVE, ANTISECRETORY, ANTISPASMODIC, ANTIULCER, BRONCHODILATOR, ANTIHISTAMINES | CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) | 1987-01-20 | — | — | US | disclosed |
| EP-0107693-A4 | 2,3,4-TRINOR-1,5-INTER-M-PHENYLENE-PROSTACYCLIN-I2 ANALOGUES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME. | CHINOIN GYOGYSZER ES VEGYESZET (HU) | 1984-09-17 | — | — | EP | disclosed |
| EP-0107693-A1 | 2,3,4-TRINOR-1,5-INTER-M-PHENYLENE-PROSTACYCLIN-I2 ANALOGUES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME. | CHINOIN GYOGYSZER ES VEGYESZET (HU) | 1984-05-09 | — | — | EP | disclosed |
| WO-1983004021-A1 | 2,3,4-TRINOR-1,5-INTER-M-PHENYLENE-PROSTACYCLINE-I2 ANALOGUES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | Chinoin Gyógyszer és Vegyészeti Termékek Gyára Rt. (HU) | 1983-11-24 | — | — | WO | disclosed |