⚠ 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 | |
|---|---|---|---|---|
| Toluene SCHEMBL28195607 | 1.00 | ACHE (0.92) | — | |
| Toluene SCHEMBL28545295 | 1.00 | ACHE (0.92) | — | |
| Toluene SCHEMBL27524894 | 0.96 | ACHE (0.85) | — | |
| Toluene SCHEMBL27492939 | 0.96 | — | — | |
| Toluene SCHEMBL27562355 | 0.96 | — | — | |
| Toluene SCHEMBL27667801 | 0.96 | ACHE (0.85) | — | |
| Toluene SCHEMBL28257888 | 0.96 | — | — | |
| Toluene SCHEMBL1 | 0.96 | — | — | |
| Toluene SCHEMBL8938900 | 0.96 | ACHE (1.00) | — | |
| Toluene SCHEMBL10976206 | 0.96 | ACHE (1.00) | — |
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 98 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117843432-A | Method and device for preparing benzene based on conversion of aromatic hydrocarbon reformate | 中国石油天然气股份有限公司 | 2024-04-09 | — | — | CN | claimed |
| CN-112759502-A | Method for inhibiting loss of aromatic ring in hydrogen reaction system and application and system thereof | 中国石油化工股份有限公司 | 2021-05-07 | — | — | CN | claimed |
| CN-107815072-A | A kind of biodegradable intermingling material of toughness reinforcing hydrolysis and preparation method thereof | 福建恒安卫生材料有限公司 | 2018-03-20 | — | — | CN | claimed |
| CN-104031093-B | A kind of ferrocene pyridine derivatives and its preparation method and application | 上海应用技术学院 | 2017-03-29 | — | — | CN | claimed |
| CN-103333097-A | Synthesis method of diindolylmethane derivatives | UNIV CHONGQING | 2013-10-02 | — | — | CN | claimed |
| US-6916932-B2 | Reductive cleavage of the exocyclic ester of UK-2A or its derivatives and products formed therefrom | DOW AGROSCIENCES LLC (US) | 2005-07-12 | — | — | US | claimed |
| CN-117843432-A | Method and device for preparing benzene based on conversion of aromatic hydrocarbon reformate | 中国石油天然气股份有限公司 | 2024-04-09 | — | — | CN | disclosed |
| CN-113620834-B | Allium macrostemon medicinal material extract, extraction method, preparation method and application | 贵州景诚制药有限公司 | 2023-12-08 | — | — | CN | disclosed |
| CN-112759502-B | Method for inhibiting aromatic ring loss in hydrogenation reaction system, application and system thereof | 中国石油化工股份有限公司 | 2023-08-29 | — | — | CN | disclosed |
| CN-114133529-A | Aromatic polyurethane resin and preparation method and application thereof | 上海华峰新材料研发科技有限公司 | 2022-03-04 | — | — | CN | disclosed |
| CN-114106280-A | Aliphatic polyurethane resin and preparation method and application thereof | 上海华峰新材料研发科技有限公司 | 2022-03-01 | — | — | CN | disclosed |
| CN-112759502-A | Method for inhibiting loss of aromatic ring in hydrogen reaction system and application and system thereof | 中国石油化工股份有限公司 | 2021-05-07 | — | — | CN | disclosed |
| CN-112521261-A | Secondary metabolite of endophytic fungi nigrospora ginkgo and bacteriostatic application thereof | 湖南科技学院 | 2021-03-19 | — | — | CN | disclosed |
| WO-1991000882-A1 | STELLATE COPOLYMERS AND THEIR PRODUCTION PROCESS | ATOCHEM (FR) | 1991-01-24 | — | — | WO | disclosed |
| EP-0408420-A1 | Star copolymers and their manufacture process | ELF ATOCHEM S.A. (FR) | 1991-01-16 | — | — | EP | disclosed |
| EP-0408429-A1 | Triblock copolymers containing at least one acrylic block, a process for their preparation and their application in the manufacture of elastomer products | ELF ATOCHEM S.A. (FR) | 1991-01-16 | — | — | EP | disclosed |
| EP-0334710-A1 | Oxidation process for a gaseous phase oxidizable charge and the reactor for carrying it out | Institut Français du Pétrole (FR) | 1989-09-27 | — | — | EP | disclosed |
| EP-0231706-B1 | OXIDATION PROCESS AND REACTOR FOR A GASEOUS PHASE OXIDIZABLE CHARGE | Institut Français du Pétrole (FR) | 1989-03-01 | — | — | EP | disclosed |
| EP-0231706-A1 | Oxidation process and reactor for a gaseous phase oxidizable charge | Institut Français du Pétrole (FR) | 1987-08-12 | — | — | EP | disclosed |
| CN-86103330-A | A kind of preparation method of novel glycopeptide derivatives | — | 1986-10-29 | — | — | CN | disclosed |