⚠ 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 | |
|---|---|---|---|---|
| Hydrogen Peroxide SCHEMBL29031161 | 0.96 | — | — | |
| SCHEMBL11735640 | 0.77 | — | — | |
| SCHEMBL8215344 | 0.72 | — | — | |
| SCHEMBL11746248 | 0.71 | — | — | |
| SCHEMBL19321611 | 0.70 | — | — | |
| SCHEMBL28457639 | 0.69 | — | — | |
| SCHEMBL28301909 | 0.69 | — | — | |
| SCHEMBL27497993 | 0.69 | — | — | |
| SCHEMBL29155557 | 0.67 | HSD11B1 (0.33) | — | |
| SCHEMBL179795 | 0.66 | — | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117282360-A | Continuous production system and process of benzoquinone | 山东鲁新设计工程股份有限公司 | 2023-12-26 | — | — | CN | disclosed |
| CN-113646414-A | Fuel oil composition | 株式会社ADEKA | 2021-11-12 | — | — | CN | disclosed |
| CN-1188215-C | Carbonylation method for epoxide derivate | SAMSUNG ELECTRONICS CO LTD (KR) | 2005-02-09 | — | — | CN | disclosed |
| EP-1122235-B1 | Process for preparing 1,3-alkanediol from epoxide derivative | DAVY PROCESS TECHN LTD (GB) | 2004-09-15 | — | — | EP | disclosed |
| US-6600065-B2 | Process for preparing 3-hydroxyesters from epoxide derivatives | DAVY PROCESS TECHNOLOGY LTD. (GB) | 2003-07-29 | — | — | US | disclosed |
| US-20030109744-A1 | PROCESS FOR PREPARING 3-HYDROXYESTERS FROM EPOXIDE DERIVATIVES | DAVY PROCESS TECHNOLOGY LTD. (GB) | 2003-06-12 | — | — | US | disclosed |
| EP-1304321-A2 | Process for preparing 3-Hydroxyesters from epoxide derivatives | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2003-04-23 | — | — | EP | disclosed |
| US-6541414-B2 | For preparing an 1,3-alkanediol through carbonylation of an epoxide derivative | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2003-04-01 | — | — | US | disclosed |
| US-6521801-B2 | Catalytic carbonylation of epoxide derivative includes reacting with alcohol and carbon monoxide to form hydroxyester which is hydrogenated to form diol | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2003-02-18 | — | — | US | disclosed |
| US-6465680-B2 | USING COBALT CATALYST AND PROMOTER | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2002-10-15 | — | — | US | disclosed |
| US-20020099245-A1 | For preparing an 1,3-alkanediol through carbonylation of an epoxide derivative | SAMSUNG ELECTRONICS CO., LTD (KR) | 2002-07-25 | — | — | US | disclosed |
| US-20020065439-A1 | Catalytic carbonylation of epoxide derivative includes reacting with alcohol and carbon monoxide to form hydroxyester which is hydrogenated to form diol | DAVY PROCESS TECHNOLOGY LIMITED (GB) | 2002-05-30 | — | — | US | disclosed |
| US-20020035290-A1 | Process for preparing malonate derivatives or beta -keto esters from epoxide derivatives | SAMSUNG ELECTRONICS CO., LTD. | 2002-03-21 | — | — | US | disclosed |
| US-6348632-B1 | Process for preparing 1,3-alkanediol from epoxide derivative | SAMSUNG ELECTRONICS CO. LTD. (KR) | 2002-02-19 | — | — | US | disclosed |
| US-6348611-B1 | NEUTRAL OR CATIONIC TRANSITION METAL CATALYST FOR USE IN HYDROFORMYLATION OF EPOXIDE DERIVATIVES | SAMSUNG ELECTRONIC CO., KTD. (KR) | 2002-02-19 | — | — | US | disclosed |
| CN-1330064-A | Method for producing malonate derivative or beta-ket-acid ester by epoxide derivative | SAMSUNG ELECTRONICS CO LTD (KR) | 2002-01-09 | — | — | CN | disclosed |
| EP-1122235-A2 | Process for preparing 1,3-alkanediol from epoxide derivative | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2001-08-08 | — | — | EP | disclosed |
| CN-1267569-A | Carbonylation method for epoxide derivate | SAMSUNG ELECTRONICS CO LTD (KR) | 2000-09-27 | — | — | CN | disclosed |
| US-4062862-A | MUSCLE RELAXANT | NIPPON CHEMIPHAR CO., LTD. (JA) | 1977-12-13 | — | — | US | disclosed |