⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL426206 | 1.00 | — | — | |
| SCHEMBL43435 | 1.00 | — | — | |
| SCHEMBL5157730 | 0.97 | — | — | |
| SCHEMBL28807781 | 0.97 | — | — | |
| SCHEMBL28303016 | 0.97 | — | — | |
| Water SCHEMBL28142347 | 0.97 | — | — | |
| SCHEMBL11691733 | 0.97 | — | — | |
| SCHEMBL5161651 | 0.97 | — | — | |
| Ethane SCHEMBL27325770 | 0.97 | SLC22A6 (0.41) | — | |
| SCHEMBL15895246 | 0.87 | CACNA2D1 (0.40) | — |
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 181 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107550913-A | Application of 4- [9- (adenine base)] -2 (the S)-beta-hydroxymethyl butyrates in treatment psoriasis and leucoderma medicament is prepared | 中国科学院上海药物研究所 | 2018-01-09 | — | — | CN | claimed |
| CN-101293831-B | Uses of 3-hydroxy fatty acid and its derivative in preparing calcium ion duct modifying agent | UNIV SHANTOU | 2013-09-18 | — | — | CN | claimed |
| CN-102168114-B | Enzymatic production of peracids from carboxylic acid ester substrates using non-heme haloperoxidases | DU PONT | 2012-10-10 | — | — | CN | claimed |
| CN-101326288-B | Production of peracids using enzymes having perhydrolysis activity | DU PONT | 2012-05-02 | — | — | CN | claimed |
| CN-101313900-B | Hydroxy fatty acid oligomer and application in regulating calcium ion concentration in cell | UNIV SHANTOU | 2012-01-04 | — | — | CN | claimed |
| CN-101300333-B | Enzymatic production of peracids from carboxylic acid ester substrates using non-heme haloperoxidases | E. I. DU PONT DE NEMOURS AND CO. (US) | 2011-11-30 | — | — | CN | claimed |
| CN-101283100-B | Enzymatic production of peracids using lactobacilli having perhydrolysis activity | DU PONT | 2011-11-02 | — | — | CN | claimed |
| CN-102168114-A | Enzymatic production of peracids from carboxylic acid ester substrates using non-heme haloperoxidases | DU PONT | 2011-08-31 | — | — | CN | claimed |
| US-7993931-B1 | Oxygen-18 labeled organic acids and use in diagnosing metabolic disorders | QUEST DIAGNOSTICS INVESTMENTS INCORPORATED (US) | 2011-08-09 | — | — | US | claimed |
| CN-101456860-B | Process for preparing 4-[9-(6-aminopurine)]-2(S)-hydroxybutyrate methyl ester | SHANGHAI INST MATERIA MEDICA | 2011-02-16 | — | — | CN | claimed |
| CN-1454219-A | A method for producing ethylene homo-and co-polymer | SAMSUNG GENERAL CHEMICALS CO (KR) | 2003-11-05 | — | — | CN | claimed |
| CN-1452637-A | Catalyst for preparing ultra-high molecular weight polyethylene and method for preparing ultra-high molecular weight polyethylene using same | SAMSUNG GENERAL CHEMICALS CO (KR) | 2003-10-29 | — | — | CN | claimed |
| CN-1373777-A | Catalyst for ethylene homo- and co-polymerization | SAMSUNG GENERAL CHEMICALS CO (KR) | 2002-10-09 | — | — | CN | claimed |
| EP-1240137-A1 | METHOD FOR MAKING 24(S)-HYDROXYVITAMIN D 2 | BONE CARE INTERNATIONAL, INC. (US) | 2002-09-18 | — | — | EP | claimed |
| CN-1359395-A | Catalyst for ethylene homo-and co-polymerization | SAMSUNG GENERAL CHEMICALS CO (KR) | 2002-07-17 | — | — | CN | claimed |
| WO-2001046131-A1 | METHOD FOR MAKING 24(S)-HYDROXYVITAMIN D¿2? | BONE CARE INTERNATIONAL, INC. (US) | 2001-06-28 | — | — | WO | claimed |
| CN-1278076-A | Agent for lowering dependence of substrate | WAKO PURE CHEM IND LTD (JP) | 2000-12-27 | — | — | CN | claimed |
| CN-1268521-A | High-activity catalyst for olefin polymerization, preparation method thereof and application of catalyst | BEIJING CHEMICAL INDUSTRY INST (CN) | 2000-10-04 | — | — | CN | claimed |
| CN-1258681-A | Catalyst for olefines polymerization and copolymerization | SAMSUNG COMPREHENSIVE CHEMICAL (KR) | 2000-07-05 | — | — | CN | claimed |
| CN-1041097-C | Highly active catalyst for polymerization of olefins and method for the preparation of the same | SAMSUNG GENERAL CHEMICALS CO (KR) | 1998-12-09 | — | — | CN | claimed |