⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27548613 | 0.85 | TRPA1 (0.35) | — | |
| SCHEMBL11847334 | 0.84 | — | — | |
| SCHEMBL4760865 | 0.82 | — | — | |
| SCHEMBL27523650 | 0.80 | — | — | |
| SCHEMBL11221370 | 0.80 | TRPA1 (0.63) | — | |
| SCHEMBL11223481 | 0.80 | TRPA1 (0.63) | — | |
| SCHEMBL15202 | 0.77 | — | — | |
| SCHEMBL330639 | 0.77 | — | — | |
| SCHEMBL330812 | 0.74 | — | — | |
| SCHEMBL7933925 | 0.74 | — | — |
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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115215862-A | Pyrimidone compounds and uses thereof | 武汉人福创新药物研发中心有限公司 | 2022-10-21 | — | — | CN | disclosed |
| CN-105531258-B | Reactive antibacterial compound and preparation method thereof | 深圳大学 | 2020-11-20 | — | — | CN | disclosed |
| US-20200216439-A1 | HETERO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2020-07-09 | — | — | US | disclosed |
| WO-2019177141-A1 | POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, METHOD OF PRODUCING POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, AND METHOD OF PRODUCING OPTICAL ARTICLE | 三井化学株式会社 | 2019-09-19 | — | — | WO | disclosed |
| CN-108026366-A | The manufacture method of polymerizable composition for optical material and the manufacture method of optical material | 三井化学株式会社 | 2018-05-11 | — | — | CN | disclosed |
| CN-108026277-A | Polymerizable composition for optical material, optical material, the manufacture method of the manufacture method of polymerizable composition for optical material and optical material | 三井化学株式会社 | 2018-05-11 | — | — | CN | disclosed |
| CN-108026241-A | Formed body and polymerizable composition for optical material | 三井化学株式会社 | 2018-05-11 | — | — | CN | disclosed |
| CN-108026240-A | Polymerizable composition for optical material, the optical material and plastic lens obtained by said composition | 三井化学株式会社 | 2018-05-11 | — | — | CN | disclosed |
| CN-107428040-A | The manufacture method of plastic lens, the localization method of film and complex | 株式会社HOPNIC研究所 | 2017-12-01 | — | — | CN | disclosed |
| CN-107209283-A | Polymerizable composition for optical material, optical material and application thereof | 三井化学株式会社 | 2017-09-26 | — | — | CN | disclosed |
| US-20100286088-A1 | 3-Substituted-4-Oxo-3,4-Dihydro-Imidazo[5,1-d][1,2,3,5-Tetrazine-8-Carboxylic Acid Amides and Their Use | PHARMINOX LIMITED (GB) | 2010-11-11 | — | — | US | disclosed |
| US-20100286088-A1 | 3-Substituted-4-Oxo-3,4-Dihydro-Imidazo[5,1-d][1,2,3,5-Tetrazine-8-Carboxylic Acid Amides and Their Use | PHARMINOX LIMITED (GB) | 2010-11-11 | — | — | US | disclosed |
| CN-1264816-C | Mercaptan and sulfenyl-(methyl) acrylate compound and their application | MITSUI CHEMICALS INC (JP) | 2006-07-19 | — | — | CN | disclosed |
| CN-1239619-C | Polythioalcohol, polymerizable compsn. resin and lens and process for preparing thio-alcohol compound | MITSUI CHEMICALS INC (JP) | 2006-02-01 | — | — | CN | disclosed |
| CN-1186320-C | Mercaptan and sulfenyl-(methyl) acrylate compound and their application | MITSUI CHEMICALS INC (JP) | 2005-01-26 | — | — | CN | disclosed |
| CN-1308061-A | Mercaptan and sulfenyl-(methyl) acrylate compound and their application | MITSUI CHEMICALS INC (JP) | 2001-08-15 | — | — | CN | disclosed |
| CN-1308060-A | Mercaptan and sulfenyl-(methyl) acrylate compound and their application | MITSUI CHEMICALS INC (JP) | 2001-08-15 | — | — | CN | disclosed |
| CN-1065528-C | Thiol and sulfur-containing O- (meth) acrylate compound and use thereof | MITSUI TOATSU CHEMICALS (JP) | 2001-05-09 | — | — | CN | disclosed |
| CN-1173490-A | Thiol and sulfur-containing 0- (meth) acrylate compound and use thereof | MITSUI TOATSU CHEMICALS (JP) | 1998-02-18 | — | — | CN | disclosed |
| EP-0055602-A2 | Oxazolidinedione sulfide compounds | ELI LILLY AND COMPANY (US) | 1982-07-07 | — | — | EP | disclosed |