⚠ 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 | |
|---|---|---|---|---|
| Acetaldehyde SCHEMBL6747 | 0.72 | — | — | |
| Acetaldehyde SCHEMBL1330497 | 0.72 | — | — | |
| Acetaldehyde SCHEMBL2338299 | 0.72 | — | — | |
| Acetaldehyde SCHEMBL20411618 | 0.72 | — | — | |
| Acetaldehyde SCHEMBL1331732 | 0.72 | — | — | |
| Acetaldehyde SCHEMBL3945841 | 0.72 | — | — | |
| Acetaldehyde SCHEMBL25291303 | 0.67 | — | — | |
| Acetaldehyde SCHEMBL6758497 | 0.67 | — | — | |
| Acetaldehyde SCHEMBL2384792 | 0.67 | — | — | |
| Acetaldehyde SCHEMBL20658915 | 0.67 | — | — |
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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20140051723-A1 | DEUTERATED N-ETHYL-N-PHENYL-1,2-DIHYDRO-4-HYDROXY-5-CHLORO-1-METHYL-2-OXOQUINOLINE-3-CARBOXAMIDE, SALTS AND USES THEREOF | TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) | 2014-02-20 | — | — | US | disclosed |
| US-8642141-B2 | Liquid crystal composition, liquid crystal element, and liquid crystal display device | SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) | 2014-02-04 | — | — | US | disclosed |
| US-8580819-B2 | Deuterated N-ethyl-N-phenyl-1,2-dihydro-4-hydroxy-5-chloro-1-methyl-2-oxoquinoline-3-carboxamide, salts and uses thereof | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2013-11-12 | — | — | US | disclosed |
| US-8563777-B2 | Ionizable isotopic labeling reagents for relative quantification by mass spectrometry | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2013-10-22 | — | — | US | disclosed |
| US-8557994-B2 | Deuterium-enriched pyridinonecarboxamides and derivatives | DHANOA DALJIT SINGH (US) | 2013-10-15 | — | — | US | disclosed |
| US-20130203706-A1 | COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2013-08-08 | — | — | US | disclosed |
| US-8501854-B2 | Templated metal oxide particles and methods of making | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2013-08-06 | — | — | US | disclosed |
| US-20130165494-A1 | 1,5-Diaryl-2-alkylpyrrole-3-Substituted Nitro Esters, Selective COX-2 Inhibitors and Nitric Oxide Donors | ROTTAPHARM S.P.A. (IT) | 2013-06-27 | — | — | US | disclosed |
| US-20130122516-A1 | DETECTING TARGETS USING MASS TAGS AND MASS SPECTROMETRY | VENTANA MEDICAL SYSTEMS, INC. | 2013-05-16 | — | — | US | disclosed |
| US-20130109757-A1 | PROCESS FOR THE PREPARATION OF PYRROLINES FROM GAMMA-NITROKETONES. USE OF THE GAMMA-NITROKETONES AS PESTICIDAL AGENTS | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2013-05-02 | — | — | US | disclosed |
| US-7579334-B2 | Compounds with anti-inflammatory activity | GLAXOSMITHKLINE ISTRAZIVACKI CENTAR ZAGREB (HR) | 2009-08-25 | — | — | US | disclosed |
| US-20090176776-A1 | SMALL MOLECULE INHIBITORS OF HIV-1 CAPSID ASSEMBLY | UNIVERSITY OF ALABAMA AT BIRMINGHAM (US) | 2009-07-09 | — | — | US | disclosed |
| US-7371779-B2 | Synergistic compositions of N-acylhomoserine lactones and 4-quinolones | THE SECRETARY OF STATE FOR DEFENSE SCIENCE AND TECHNOLOGY (GB) | 2008-05-13 | — | — | US | disclosed |
| US-20080096830-A1 | Anti-Inflammatory Macrolide Conjugates | GLAXOSMITHKLINE ISTRAZIVACKI CENTAR ZAGREB D.O.O. (HR) | 2008-04-24 | — | — | US | disclosed |
| US-20080090803-A1 | FATTY ALCOHOL DRUG CONJUGATES | LUITPOLD PHARMACEUTICALS, INC. (US) | 2008-04-17 | — | — | US | disclosed |
| US-20080081807-A1 | Arylphenyl-substituted cyclic keto-enols | LIEB FOLKER | 2008-04-03 | — | — | US | disclosed |
| US-20080050833-A1 | Ionizable isotopic labeling reagents for relative quantification by mass spectrometry | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS | 2008-02-28 | — | — | US | disclosed |
| US-7323536-B2 | Reaction product obtained by melt blending an aromatic polyester-polycarbonate and a transesterification catalyst that has a haze of less than 5.0% | GENERAL ELECTRIC COMPANY (US) | 2008-01-29 | — | — | US | disclosed |
| US-7320984-B2 | Remedies or preventives for urinary frequency or urinary incontinence and morphinan derivatives having nitrogen-containing heterocyclic group | TORAY INDUSTRIES, INC. (JP) | 2008-01-22 | — | — | US | disclosed |
| US-20070015757-A1 | Novel Glucagon Antagonists/Inverse Agonists | NOVO NORDISK A/S (DK) | 2007-01-18 | — | — | US | disclosed |