⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11411865 | 0.79 | TSHR (0.42) | — | |
| SCHEMBL225608 | 0.77 | FBP1 (0.55) | — | |
| SCHEMBL29543966 | 0.77 | RHEB (0.55) | — | |
| SCHEMBL6915666 | 0.77 | RHEB (0.55) | — | |
| SCHEMBL31464849 | 0.77 | FBP1 (0.55) | — | |
| SCHEMBL30548744 | 0.74 | RHEB (0.53) | — | |
| SCHEMBL1846441 | 0.74 | — | — | |
| SCHEMBL23183061 | 0.72 | — | — | |
| SCHEMBL1816007 | 0.72 | — | — | |
| SCHEMBL515471 | 0.72 | — | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1345889-A1 | METHOD FOR THE REGIOSELECTIVE PREPARATION OF SUBSTITUTED BENZO G]QUINOLINE-3-CARBONITRILES AND BENZO G]QUINAZOLINES | Wyeth (US) | 2003-09-24 | — | — | EP | claimed |
| WO-2002053528-A1 | METHOD FOR THE REGIOSELECTIVE PREPARATION OF SUBSTITUTED BENZO[G]QUINOLINE-3-CARBONITRILES AND BENZO[G]QUINAZOLINES | WYETH (US) | 2002-07-11 | — | — | WO | claimed |
| CN-118652272-A | Method for synthesizing thiophosphorus/phosphinic acid ester compound | 中国人民解放军军事科学院防化研究院 | 2024-09-17 | — | — | CN | disclosed |
| CN-115028641-A | Method for synthesizing 5, 8-bifunctional substituted imidazo [1,2-a ] pyrazine compound by cobalt catalysis | 湖南大学 | 2022-09-09 | — | — | CN | disclosed |
| WO-2020185928-A1 | CHARGED ION CHANNEL BLOCKERS AND METHODS FOR USE | Nocion Therapeutics, Inc. (US) | 2020-09-17 | — | — | WO | disclosed |
| CN-107620088-B | A kind of method of electrochemical catalytic oxidation synthesis 3- sulfydryl indole class compound | 浙江工业大学 | 2019-05-07 | — | — | CN | disclosed |
| US-9949480-B2 | N-alkylthio beta-lactams, alkyl-coenzyme A asymmetric disulfides, and aryl-alkyl disulfides as anti-bacterial agents | UNIVERSITY OF SOUTH FLORIDA (US) | 2018-04-24 | — | — | US | disclosed |
| CN-107620088-A | A kind of method that electrochemical catalytic oxidation synthesizes 3 sulfydryl indole class compounds | 浙江工业大学 | 2018-01-23 | — | — | CN | disclosed |
| US-20150327547-A1 | N-ALKYLTHIO BETA-LACTAMS, ALKYL-COENZYME A ASYMMETRIC DISULFIDES, AND ARYL-ALKYL DISULFIDES AS ANTI-BACTERIAL AGENTS | UNIVERSITY OF SOUTH FLORIDA (US) | 2015-11-19 | — | — | US | disclosed |
| US-9096635-B2 | N-alkylthio beta-lactams, alkyl-coenzyme A asymmetric disulfides, and aryl-alkyl disulfides as anti-bacterial agents | UNIVERSITY OF SOUTH FLORIDA (US) | 2015-08-04 | — | — | US | disclosed |
| US-20140235565-A1 | N-ALKYLTHIO BETA-LACTAMS, ALKYL-COENZYME A ASYMMETRIC DISULFIDES, AND ARYL-ALKYL DISULFIDES AS ANTI-BACTERIAL AGENTS | UNIVERSITY OF SOUTH FLORIDA (US) | 2014-08-21 | — | — | US | disclosed |
| US-8722937-B2 | Asymmetric disulfides and aryl-alkyl disulfides as anti-bacterial agents | UNIVERSITY OF SOUTH FLORIDA (US) | 2014-05-13 | — | — | US | disclosed |
| CN-101497700-B | Method for manufacturing molded body and optical injection molded body | JSR CORP | 2012-10-31 | — | — | CN | disclosed |
| CN-101175792-B | Curable composition | MITSUBISHI GAS CHEMICAL CO | 2011-01-26 | — | — | CN | disclosed |
| CN-101497700-A | Method for manufacturing molded body and optical injection molded body | JSP CORP (JP) | 2009-08-05 | — | — | CN | disclosed |
| US-20080182815-A1 | Act against several infective agents, and most notably Bacillus spp. and Staphylococcus spp., including infection caused by methicillin-resistant Staphylococcus aureus (MRSA) | UNIVERSITY OF SOUTH FLORIDA | 2008-07-31 | — | — | US | disclosed |
| CN-101180303-A | Metal hydride complex, method of hydrogenating ring-opening polymerization polymer of cycloolefin, and process for producing product of hydrogenation of ring-opening polymerization polymer of cycloole | JSR CORP (JP) | 2008-05-14 | — | — | CN | disclosed |
| CN-101175792-A | curable composition | MITSUBISHI GAS CHEMICAL CO (JP) | 2008-05-07 | — | — | CN | disclosed |
| US-4825002-A | LEWIS ACID, ALKALI METAL HYDROXIDE | ETHYL CORPORATION (US) | 1989-04-25 | — | — | US | disclosed |