⚠ 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 | |
|---|---|---|---|---|
| Chloromethane SCHEMBL8775781 | 0.98 | DGKA (0.54) | — | |
| Cyclohexane SCHEMBL27791493 | 0.94 | DGKA (0.50) | — | |
| SCHEMBL1044001 | 0.93 | DGKA (0.65) | — | |
| SCHEMBL2857061 | 0.91 | DGKA (0.69) | — | |
| SCHEMBL353797 | 0.91 | DGKA (0.69) | — | |
| SCHEMBL356145 | 0.91 | DGKA (0.69) | — | |
| SCHEMBL355177 | 0.91 | DGKA (0.69) | — | |
| SCHEMBL30979409 | 0.91 | DGKA (0.69) | — | |
| SCHEMBL10414846 | 0.91 | DGKA (0.69) | — | |
| SCHEMBL6266491 | 0.91 | DGKA (0.69) | — |
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 140 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2903979-B1 | NOVEL COMPOUNDS, THEIR PREPARATION AND THEIR USES | INHIBIKASE THERAPEUTICS INC (US) | 2020-08-19 | — | — | EP | claimed |
| CN-109988116-A | A kind of synthetic method of 2- methylol -5- trifluoromethyl pyrimidine | 上海吉奉生物科技有限公司 | 2019-07-09 | — | — | CN | claimed |
| CN-109608436-A | Substituted Methylformyl reagent and the method for improving compound physical chemistry and/or pharmacokinetic property using the reagent | 斯法尔制药私人有限公司 | 2019-04-12 | — | — | CN | claimed |
| CN-107501268-A | A kind of preparation method of L-084 and its intermediate | 浙江海翔川南药业有限公司 | 2017-12-22 | — | — | CN | claimed |
| CN-106083854-B | A kind of hypoxemia activation AGT protein inhibitors and preparation method and application | 北京工业大学 | 2017-10-27 | — | — | CN | claimed |
| CN-106432330-A | Intermediate compound of medicine LB80380 and preparing method and application thereof | 天津科伦药物研究有限公司 | 2017-02-22 | — | — | CN | claimed |
| CN-106083854-A | A kind of hypoxia activates AGT protein inhibitor and preparation method and application | 北京工业大学 | 2016-11-09 | — | — | CN | claimed |
| US-9487500-B2 | Compounds and compositions thereof | INHIBIKASE THERAPEUTICS, INC. (US) | 2016-11-08 | — | — | US | claimed |
| US-9359376-B2 | Substituted methylformyl reagents and method of using same to modify physicochemical and/or pharmacokinetic properties of compounds | SPHAERA PHARMA PTE. LTD (SG) | 2016-06-07 | — | — | US | claimed |
| EP-2903979-A1 | NOVEL COMPOUNDS, THEIR PREPARATION AND THEIR USES | Inhibikase Therapeutics, Inc. (US) | 2015-08-12 | — | — | EP | claimed |
| US-20140100225-A1 | NOVEL COMPOUNDS, THEIR PREPARATION AND THEIR USES | INHIBIKASE THERAPEUTICS, INC. (US) | 2014-04-10 | — | — | US | claimed |
| WO-2014055938-A1 | NOVEL COMPOUNDS, THEIR PREPARATION AND THEIR USES | INHIBIKASE THERAPEUTICS, INC. (US) | 2014-04-10 | — | — | WO | claimed |
| CN-103607888-A | Substituted methyl formyl reagents and methods of using the same to improve physicochemical and/or pharmacokinetic properties of compounds | SPHAERA PHARMA PRIVATE LTD | 2014-02-26 | — | — | CN | claimed |
| EP-2693876-A1 | SUBSTITUTED METHYLFORMYL REAGENTS AND METHOD OF USING SAME TO MODIFY PHYSICOCHEMICAL AND/OR PHARMACOKINETIC PROPERTIES OF COMPOUNDS | Sphaera Pharma Pte. Ltd (SG) | 2014-02-12 | — | — | EP | claimed |
| WO-2012137225-A1 | SUBSTITUTED METHYLFORMYL REAGENTS AND METHOD OF USING SAME TO MODIFY PHYSICOCHEMICAL AND/OR PHARMACOKINETIC PROPERTIES OF COMPOUNDS | SPHAERA PHARMA PVT. LTD (IN) | 2012-10-11 | — | — | WO | claimed |
| EP-0966429-B1 | VALNOCTAMIDE STEREOISOMERS, A METHOD FOR THEIR SYNTHESIS AND SEPARATION AND USES THEREOF | YISSUM RES DEV CO (IL) | 2003-06-04 | — | — | EP | claimed |
| EP-0966429-A1 | VALNOCTAMIDE STEREOISOMERS, A METHOD FOR THEIR SYNTHESIS AND SEPARATION AND USES THEREOF | YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) | 1999-12-29 | — | — | EP | claimed |
| WO-1998030536-A1 | VALNOCTAMIDE STEREOISOMERS, A METHOD FOR THEIR SYNTHESIS AND SEPARATION AND USES THEREOF | YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) | 1998-07-16 | — | — | WO | claimed |
| CN-1168661-A | Preparation of pentenoic acid | DU PONT (US) | 1997-12-24 | — | — | CN | claimed |
| US-5536873-A | Preparation of pentenoic acid | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-07-16 | — | — | US | claimed |