⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5381405 | 0.75 | — | — | |
| SCHEMBL17222372 | 0.72 | — | — | |
| Water SCHEMBL597799 | 0.72 | MCL1 (0.31) | — | |
| SCHEMBL31494789 | 0.71 | — | — | |
| SCHEMBL5773276 | 0.71 | — | — | |
| SCHEMBL2746954 | 0.71 | — | — | |
| Ethylene SCHEMBL7563790 | 0.71 | MCL1 (0.33) | — | |
| SCHEMBL20456241 | 0.69 | — | — | |
| Cyclohexane SCHEMBL7563233 | 0.69 | EPHX1 (0.37) | — | |
| SCHEMBL27746025 | 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 129 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107531688-A | Process for the preparation of L-alanyl-L-alanine 2- {4- [2- ({ [2 (4-chlorophenyl) -1, 3-thiazol-4-yl ] methyl } sulfanyl) -3, 5-dicyano-6- (pyrrolidin-1-yl) pyridin-4-yl ] phenoxy } ethyl ester monohydrochloride | 拜耳制药股份公司 | 2018-01-02 | — | — | CN | claimed |
| CN-105060279-B | Three-dimensional porous nitrogen-doped graphene prepared by a kind of Graft Method and preparation method | 青岛大学 | 2016-08-24 | — | — | CN | claimed |
| CN-103951640-B | A kind of compound and preparation thereof and purposes | SUZHOU UNIVERSITY (CN) | 2016-03-02 | — | — | CN | claimed |
| CN-105060279-A | Grafting method for preparing three-dimensional porous nitrogen-doped graphene | UNIV QINGDAO | 2015-11-18 | — | — | CN | claimed |
| CN-102395273-B | Thienopyridine derivatives for the treatment and prevention of dengue virus infection | SIGA TECHNOLOGIES INC | 2015-05-20 | — | — | CN | claimed |
| CN-103951640-A | Compound and preparation method and application thereof | UNIV SOOCHOW | 2014-07-30 | — | — | CN | claimed |
| CN-103242242-A | 5-electron-defect alkenyl substituted pyrimidine carbocyclic ring nucleoside and preparation method | UNIV HENAN NORMAL | 2013-08-14 | — | — | CN | claimed |
| CN-102532124-A | Preparation method of fluorine-containing heterocyclic compound of pesticide intermediate | SHANGHAI SINOFLUORO SCIENT CO | 2012-07-04 | — | — | CN | claimed |
| CN-102395273-A | Thienopyridine derivatives for the treatment and prevention of dengue virus infection | SIGA TECHNOLOGIES INC | 2012-03-28 | — | — | CN | claimed |
| CN-102030759-A | Thienopyridine derivative, and preparation method and application thereof | UNIV SICHUAN | 2011-04-27 | — | — | CN | claimed |
| CN-1489577-A | Cyanothioacetamide derivatives and process for preparing same | �ձ�������ʽ���� | 2004-04-14 | — | — | CN | claimed |
| CN-110352256-A | The technique for leaching metal sulfide with the reagent with thiocarbonyl functionality | 不列颠哥伦比亚大学 | 2019-10-18 | — | — | CN | disclosed |
| CN-106928250-B | 2-oxadiazole-3-aminothieno [2,3-b ] pyridine derivative and preparation method and application thereof | 四川大学 | 2019-09-27 | — | — | CN | disclosed |
| CN-110072936-A | Curable polymer latex composition for rubber product manufacture | 昕特玛私人有限公司 | 2019-07-30 | — | — | CN | disclosed |
| CN-109928983-A | 2- oxadiazoles -3- aminothiophene simultaneously [2,3-b] pyridine derivate and its preparation method and application | 四川大学 | 2019-06-25 | — | — | CN | disclosed |
| EP-0144594-B1 | Derivatives of 5H-[1]benzopyrano-[2,3-d]-pyrimidines, process for their preparation and medicines containing them, useful against gastral and duodenal lesions of the mucosa | GÖDECKE AKTIENGESELLSCHAFT (DE) | 1987-10-07 | — | — | EP | disclosed |
| EP-0138137-B1 | 4-Thioxo-benzopyrano[2,3-d]pyrimidine derivatives and process for their preparation | GÖDECKE AKTIENGESELLSCHAFT (DE) | 1987-07-22 | — | — | EP | disclosed |
| US-4584374-A | 4-thioxo-benzopyrano[2,3-d]pyrimidine derivatives | WARNER-LAMBERT COMPANY (US) | 1986-04-22 | — | — | US | disclosed |
| US-4578380-A | 5H-[1]benzopyrano[2,3-d]pyrimidine derivatives useful for controlling lesions of the gastric and duodenal mucous membranes | WARNER-LAMBERT COMPANY (US) | 1986-03-25 | — | — | US | disclosed |
| EP-0144594-A1 | Derivatives of 5H-[1]benzopyrano-[2,3-d]-pyrimidines, process for their preparation and medicines containing them, useful against gastral and duodenal lesions of the mucosa | GÖDECKE AKTIENGESELLSCHAFT (DE) | 1985-06-19 | — | — | EP | disclosed |