⚠ 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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL10493963 | 0.88 | — | — | |
| Trichloroethane SCHEMBL64609 | 0.87 | — | — | |
| Trichloroethane SCHEMBL3833855 | 0.87 | TSHR (1.00) | — | |
| Trichloroethane SCHEMBL10482068 | 0.87 | TSHR (1.00) | — | |
| Trichloroethane SCHEMBL16434 | 0.87 | — | — | |
| Tert-Butanol SCHEMBL9551992 | 0.82 | TSHR (0.67) | — | |
| Trichloroethane SCHEMBL25372481 | 0.80 | — | — | |
| Trichloroethane SCHEMBL4603454 | 0.80 | TSHR (0.86) | — | |
| Trichloroethane SCHEMBL8720044 | 0.80 | TSHR (0.86) | — | |
| Trichloroethane SCHEMBL4605092 | 0.80 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5196094-A | Separation of 1,1,1-trichloroethane from the lower alcohols by extractive distillation | Berg, Lloyd (US) | 1993-03-23 | — | — | US | claimed |
| US-10662384-B2 | Methods for analyzing hydrocarbons and hydrocarbon blends for chemical compositions | THE UNIVERSITY OF WYOMING RESEARCH CORPORATION (US) | 2020-05-26 | — | — | US | disclosed |
| US-20190106639-A1 | Methods For Analyzing Hydrocarbons And Hydrocarbon Blends For Chemical Compositions | WESTERN RESEARCH INSTITUTE, INC. | 2019-04-11 | — | — | US | disclosed |
| US-10221363-B2 | Methods of successive elution of components of hydrocarbons | THE UNIVERSITY OF WYOMING RESEARCH CORPORATION (US) | 2019-03-05 | — | — | US | disclosed |
| CN-108368414-A | Oily gelling agent | 国立大学法人静冈大学 | 2018-08-03 | — | — | CN | disclosed |
| US-20160272899-A1 | Methods of Successive Elution of Components of Hydrocarbons | UNIVERSITY OF WYOMING RESEARCH CORPORATION D/B/A WESTERN RESEARCH INSTITUTE (US) | 2016-09-22 | — | — | US | disclosed |
| US-9353317-B2 | Hydrocarbon separation and analysis apparatus and methods | THE UNIVERSITY OF WYOMING RESEARCH CORPORATION (US) | 2016-05-31 | — | — | US | disclosed |
| US-20130067991-A1 | Hydrocarbon Separation and Analysis Apparatus and Methods | UNIVERSITY OF WYOMING RESEARCH CORPORATION D/B/A WESTERN RESEARCH INSTITUTE (US) | 2013-03-21 | — | — | US | disclosed |
| CN-1164628-C | Process for preparing sulfonated syndiotactic polyphenylethylene | 中国石油化工股份有限公司 | 2004-09-01 | — | — | CN | disclosed |
| CN-1377902-A | Process for preparing sulfonated syndiotactic polyphenylethylene | CHINA PETROCHEMICAL CORP (CN) | 2002-11-06 | — | — | CN | disclosed |
| US-5196094-A | Separation of 1,1,1-trichloroethane from the lower alcohols by extractive distillation | Berg, Lloyd (US) | 1993-03-23 | — | — | US | disclosed |
| US-4070189-A | CATIONIC POLYBENZYLVINYL AMMONIUM OR PHOSPHONIUM SALT | EASTMAN KODAK COMPANY (US) | 1978-01-24 | — | — | US | disclosed |