⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25238225 | 0.81 | THRB (0.42) | — | |
| SCHEMBL6008604 | 0.79 | THRB (0.36) | — | |
| SCHEMBL6009963 | 0.77 | THRB (0.34) | — | |
| SCHEMBL6009853 | 0.75 | THRB (0.38) | — | |
| SCHEMBL226310 | 0.75 | ALDH1A1 (0.42) | — | |
| SCHEMBL153663 | 0.73 | THRB (0.33) | — | |
| SCHEMBL5915197 | 0.73 | — | — | |
| SCHEMBL52 | 0.72 | CA2 (0.35) | — | |
| SCHEMBL27623481 | 0.72 | CA2 (0.35) | — | |
| SCHEMBL31253458 | 0.71 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110642750-A | Preparation method of perfluoroalkyl nitrile | 三明市海斯福化工有限责任公司 | 2020-01-03 | — | — | CN | claimed |
| WO-2024104450-A1 | METHOD FOR PREPARING HEPTAFLUOROISOBUTYRONITRILE BY GAS-PHASE CATALYSIS | 浙江省化工研究院有限公司 | 2024-05-23 | — | — | WO | disclosed |
| CN-118056809-A | Method for preparing heptafluoroisobutyronitrile by gas phase catalysis | 浙江省化工研究院有限公司 | 2024-05-21 | — | — | CN | disclosed |
| CN-118056810-A | Method for preparing heptafluoroisobutyronitrile by liquid phase catalysis | 浙江省化工研究院有限公司 | 2024-05-21 | — | — | CN | disclosed |
| CN-118056811-A | Method for preparing fluorine-containing nitrile compound by dehydrating amide compound | 浙江省化工研究院有限公司 | 2024-05-21 | — | — | CN | disclosed |
| CN-117776972-A | Method for synthesizing heptafluoroisobutyronitrile | 昊华气体有限公司 | 2024-03-29 | — | — | CN | disclosed |
| CN-110642750-A | Preparation method of perfluoroalkyl nitrile | 三明市海斯福化工有限责任公司 | 2020-01-03 | — | — | CN | disclosed |
| US-9671693-B2 | Resist composition and method for producing resist pattern | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2017-06-06 | — | — | US | disclosed |
| US-9563124-B2 | Photoresist composition and method for producing photoresist pattern | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2017-02-07 | — | — | US | disclosed |
| US-9291893-B2 | Resist composition and method for producing resist pattern | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2016-03-22 | — | — | US | disclosed |
| US-20140030654-A1 | PHOTORESIST COMPOSITION AND METHOD FOR PRODUCING PHOTORESIST PATTERN | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2014-01-30 | — | — | US | disclosed |
| US-8574811-B2 | Resist composition and method for producing resist pattern | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-11-05 | — | — | US | disclosed |
| US-20120156620-A1 | RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-06-21 | — | — | US | disclosed |
| US-20120100483-A1 | RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-04-26 | — | — | US | disclosed |
| US-20120052443-A1 | RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-03-01 | — | — | US | disclosed |
| US-4255594-A | Hydrogenation of halogen-containing carboxylic anhydrides | ALLIED CHEMICAL CORPORATION (US) | 1981-03-10 | — | — | US | disclosed |