⚠ 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL29101364 | 0.96 | TSHR (0.31) | — | |
| Bicarbonate SCHEMBL31411211 | 0.87 | FFAR3 (0.37) | — | |
| Oxalic Acid SCHEMBL11125463 | 0.84 | ALOX15 (0.37) | — | |
| SCHEMBL31131462 | 0.82 | — | — | |
| SCHEMBL1678760 | 0.79 | — | — | |
| SCHEMBL31389348 | 0.79 | — | — | |
| SCHEMBL5180978 | 0.79 | — | — | |
| SCHEMBL3401104 | 0.79 | — | — | |
| SCHEMBL12408046 | 0.79 | — | — | |
| SCHEMBL19268291 | 0.79 | — | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-221432150-U | Catalyst recovery system for p-nitrodiethyl ether | 江苏中丹化工技术有限公司 | 2024-07-30 | — | — | CN | disclosed |
| CN-110233290-A | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery using same | 三菱化学株式会社 | 2019-09-13 | — | — | CN | disclosed |
| CN-104966849-B | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery using same | 三菱化学株式会社 | 2019-06-07 | — | — | CN | disclosed |
| WO-2017072722-A1 | CGRP RECEPTOR ANTAGONISTS | HEPTARES THERAPEUTICS LIMITED (GB) | 2017-05-04 | — | — | WO | disclosed |
| CN-104167564-B | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery | 三菱化学株式会社 | 2017-04-12 | — | — | CN | disclosed |
| CN-104966849-A | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery using same | MITSUBISHI CHEM CORP | 2015-10-07 | — | — | CN | disclosed |
| CN-102623747-B | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery using same | MITSUBISHI CHEM CORP | 2015-02-18 | — | — | CN | disclosed |
| CN-101884629-B | Controlled release preparation | TAKEDA PHARMACEUTICAL | 2013-08-21 | — | — | CN | disclosed |
| CN-1713897-B | Controlled release formulations | TAKEDA CHEMICAL INDUSTRIES LTD | 2012-07-04 | — | — | CN | disclosed |
| CN-102089269-A | Process for the separation of carboxylic acids bearing at least one halogen atom in salified form | RHODIA OPERATIONS | 2011-06-08 | — | — | CN | disclosed |
| US-7923573-B2 | Benzene compound having 2 or more substituents | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2011-04-12 | — | — | US | disclosed |
| CN-101884629-A | Controlled release preparation | TAKEDA PHARMACEUTICAL | 2010-11-17 | — | — | CN | disclosed |
| US-20080255111-A1 | Tissue Factor Production Inhibitor | SANKYO COMPANY LIMITED (JP) | 2008-10-16 | — | — | US | disclosed |
| US-20080004301-A1 | Benzene Compound Having 2 or More Substituents | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2008-01-03 | — | — | US | disclosed |
| EP-1806332-A1 | BENZENE COMPOUND HAVING 2 OR MORE SUBSTITUENTS | Daiichi Sankyo Company, Limited (JP) | 2007-07-11 | — | — | EP | disclosed |
| EP-1764075-A1 | TISSUE FACTOR PRODUCTION INHIBITOR | Sankyo Company, Limited (JP) | 2007-03-21 | — | — | EP | disclosed |
| CN-1713897-A | Controlled release formulations | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2005-12-28 | — | — | CN | disclosed |
| CN-1678315-A | Prodrugs of imidazole derivatives as proton pump inhibitors for the treatment of e.g. peptic ulcers | TAKEDA PHARMACEUTICAL (JP) | 2005-10-05 | — | — | CN | disclosed |