⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24469792 | 0.67 | — | — | |
| SCHEMBL3281346 | 0.65 | — | — | |
| SCHEMBL23098958 | 0.60 | — | — | |
| SCHEMBL24546096 | 0.55 | — | — | |
| SCHEMBL11675984 | 0.55 | — | — | |
| SCHEMBL50056 | 0.54 | — | — | |
| SCHEMBL2031403 | 0.54 | EPHX1 (0.32) | — | |
| SCHEMBL24438857 | 0.52 | — | — | |
| SCHEMBL1527763 | 0.51 | — | — | |
| SCHEMBL12191963 | 0.48 | — | — |
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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2780346-B1 | PROCESS FOR PREPARING METAL DIFLUOROCHELATOBORATES AND USE AS BATTERY ELECTROLYTES OR ADDITIVES IN ELECTROCHEMICAL CELLS | ALBEMARLE GERMANY GMBH (DE) | 2019-10-16 | — | — | EP | disclosed |
| WO-2017043645-A1 | CYCLIC AZINE COMPOUND, AND PRODUCTION METHOD, PRODUCTION INTERMEDIATE, AND USE THEREOF | 東ソー株式会社 | 2017-03-16 | — | — | WO | disclosed |
| US-20170044132-A1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2017-02-16 | — | — | US | disclosed |
| US-20170033359-A1 | SECONDARY BATTERY | KYOTO UNIVERSITY (JP) | 2017-02-02 | — | — | US | disclosed |
| US-20170033359-A1 | SECONDARY BATTERY | KYOTO UNIVERSITY (JP) | 2017-02-02 | — | — | US | disclosed |
| US-9409927-B2 | Super lewis acidic borate esters as 18F-labeled PET probes | H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) | 2016-08-09 | — | — | US | disclosed |
| US-20150361110-A1 | SUPER LEWIS ACIDIC BORATE ESTERS AS 18F-LABELED PET PROBES | H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. | 2015-12-17 | — | — | US | disclosed |
| EP-2821401-A1 | HETEROCYCLIC COMPOUND AND USE THEREFOR | Takeda Pharmaceutical Company Limited (JP) | 2015-01-07 | — | — | EP | disclosed |
| US-20140288331-A1 | PROCESS FOR PREPARING METAL DIFLUOROCHELATOBORATES AND USE AS BATTERY ELECTROLYTES OR ADDITIVES IN ELECTROCHEMICAL CELLS | Rockwood Lithium GmbH (DE) | 2014-09-25 | — | — | US | disclosed |
| US-20140288331-A1 | PROCESS FOR PREPARING METAL DIFLUOROCHELATOBORATES AND USE AS BATTERY ELECTROLYTES OR ADDITIVES IN ELECTROCHEMICAL CELLS | Rockwood Lithium GmbH (DE) | 2014-09-25 | — | — | US | disclosed |
| US-8563761-B2 | Boron or aluminum complexes | CENTRE NATIONAL DE LA RECHERCHE (FR) | 2013-10-22 | — | — | US | disclosed |
| EP-2646511-A1 | CURABLE COMPOSITION | Construction Research & Technology GmbH (DE) | 2013-10-09 | — | — | EP | disclosed |
| WO-2013065836-A1 | PROCESS FOR PRODUCING FUSED-RING AROMATIC COMPOUND, AND CONJUGATED POLYMER | 三菱化学株式会社 (JP) | 2013-05-10 | — | — | WO | disclosed |
| US-8207337-B2 | Reagent for organic synthesis reaction containing organic triol borate salt | WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) | 2012-06-26 | — | — | US | disclosed |
| WO-2012072502-A1 | CURABLE COMPOSITION | CONSTRUCTION RESEARCH & TECHNOLOGY GMBH (DE) | 2012-06-07 | — | — | WO | disclosed |
| US-20110171112-A1 | BORON OR ALUMINUM COMPLEXES | UNIVERSITE DE PICARDIE JULES VERNE (FR) | 2011-07-14 | — | — | US | disclosed |
| EP-2276772-A2 | BORON OR ALUMINUM COMPLEXES | Centre National de la Recherche Scientifique (FR) | 2011-01-26 | — | — | EP | disclosed |
| US-20100087646-A1 | REAGENT FOR ORGANIC SYNTHESIS REACTION CONTAINING ORGANIC TRIOL BORATE SALT | WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) | 2010-04-08 | — | — | US | disclosed |
| WO-2009122044-A2 | BORON OR ALUMINUM COMPLEXES | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2009-10-08 | — | — | WO | disclosed |
| CN-1031578-C | Homogeneous olfin polymerization catalyst by abstraction with borane | DOW CHEMICAL CO (US) | 1996-04-17 | — | — | CN | disclosed |