⚠ 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 | |
|---|---|---|---|---|
| Methane SCHEMBL27768265 | 0.98 | ALDH1A1 (0.59) | — | |
| Propane SCHEMBL27968122 | 0.94 | ALDH1A1 (0.55) | — | |
| SCHEMBL27838743 | 0.90 | ALDH1A1 (0.52) | — | |
| SCHEMBL13130702 | 0.81 | ALDH1A1 (0.61) | — | |
| SCHEMBL11078493 | 0.80 | CES2 (0.58) | — | |
| SCHEMBL1921316 | 0.80 | ALDH1A1 (0.67) | — | |
| SCHEMBL1515056 | 0.80 | — | — | |
| Iodide SCHEMBL27882126 | 0.79 | ALDH1A1 (0.59) | — | |
| SCHEMBL1930639 | 0.78 | — | — | |
| SCHEMBL947176 | 0.78 | — | — |
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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117624034-A | Nitro-substituted nickel picolinate (II) catalyst for preparing linear low-density polyethylene | 中国科学院化学研究所 | 2024-03-01 | — | — | CN | disclosed |
| EP-3642209-B1 | COMPOUNDS THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE | SHY Therapeutics LLC (US) | 2023-11-29 | — | — | EP | disclosed |
| WO-2023166232-A1 | COMPOUNDS DERIVED FROM 4-AMINO-N-(4-AMINOPHENYL)BENZAMIDE AND ANALOGUES AND USE THEREOF | CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) | 2023-09-07 | — | — | WO | disclosed |
| EP-4013738-A1 | PROCESS FOR PREPARING 1-INDANONE COMPOUNDS BY INTRAMOLECULAR FRIEDEL-CRAFTS REACTION OF ALPHA,ALPHA-DIALKYLMALONATE DERIVATIVES | Firmenich SA (CH) | 2022-06-22 | — | — | EP | disclosed |
| US-20210408400-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2021-12-30 | — | — | US | disclosed |
| EP-3601273-B1 | 4-PIPERIDIN-N-(PYRIMIDIN-4-YL)CHROMAN-7-SULFONAMIDE DERIVATIVES AS SODIUM CHANNEL INHIBITORS | GENENTECH INC (US) | 2021-12-01 | — | — | EP | disclosed |
| US-10790464-B2 | Organic light-emitting device | SAMSUNG DISPLAY CO., LTD. (KR) | 2020-09-29 | — | — | US | disclosed |
| WO-2020107221-A1 | CHEMICAL ACTIVATORS OF NICOTINAMIDE MONONUCLEOTIDE ADENLYLY TRANSFERASE 2 (NMNAT2) AND USES THEREOF | TSINGHUA UNIVERSITY (CN) | 2020-06-04 | — | — | WO | disclosed |
| US-10550203-B2 | Polymers functionalized with heterocyclic nitrile compounds | BRIDGESTONE CORPORATION (JP) | 2020-02-04 | — | — | US | disclosed |
| EP-3542821-A1 | p53 DEGRADATION INDUCING MOLECULE AND PHARMACEUTICAL COMPOSITION | Tokyo University of Science Foundation (JP) | 2019-09-25 | — | — | EP | disclosed |
| US-7915293-B2 | Carbocyclic and heterocyclic sulfonamide derivatives, e.g., N-(2-bromo-5-(trifluoromethoxy)phenyl)-3,5-dichloro-4-(2-chloro-4-nitrophenoxy)benzenesulfonamide and 4-(2-(trifluoromethyl)phenoxy)-1-(3-trifluoromethyl)phenylsulfonyl)piperidine; treating proliferative diseases | RIGEL PHARMACEUTICALS, INC. (US) | 2011-03-29 | — | — | US | disclosed |
| US-7915293-B2 | Carbocyclic and heterocyclic sulfonamide derivatives, e.g., N-(2-bromo-5-(trifluoromethoxy)phenyl)-3,5-dichloro-4-(2-chloro-4-nitrophenoxy)benzenesulfonamide and 4-(2-(trifluoromethyl)phenoxy)-1-(3-trifluoromethyl)phenylsulfonyl)piperidine; treating proliferative diseases | RIGEL PHARMACEUTICALS, INC. (US) | 2011-03-29 | — | — | US | disclosed |
| WO-2007087204-A2 | HETEROCYCLES AS NICOTINIC ACID RECEPTOR AGONISTS FOR THE TREATMENT OF DYYSLIPIDEMIA | SCHERING CORPOORATION (US) | 2007-08-02 | — | — | WO | disclosed |
| US-7129305-B2 | Heterocyclic-amide catalyst compositions for the polymerization of olefins | UNIVATION TECHNOLOGIES, LLC (US) | 2006-10-31 | — | — | US | disclosed |
| EP-1622957-A2 | POLYURETHANE DISPERSANTS | THE LUBRIZOL CORPORATION (US) | 2006-02-08 | — | — | EP | disclosed |
| US-6864205-B2 | Heterocyclic-amide catalyst compositions for the polymerization of olefins | UNIVATION TECHNOLOGIES, LLC (US) | 2005-03-08 | — | — | US | disclosed |
| US-20050038211-A1 | Heterocyclic-amide catalyst compositions for the polymerization of olefins | MURRAY REX EUGENE (US) | 2005-02-17 | — | — | US | disclosed |
| WO-2005007621-A2 | UBIQUITIN LIGASE INHIBITORS | RIGEL PHARMACEUTICALS, INC. (US) | 2005-01-27 | — | — | WO | disclosed |
| WO-2004104064-A2 | POLYURETHANE DISPERSANTS | THE LUBRIZOL CORPORATION (US) | 2004-12-02 | — | — | WO | disclosed |
| US-20030166454-A1 | Heterocyclic-amide catalyst compositions for the polymerization of olefins | UNIVATION TECHNOLOGIES, LLC | 2003-09-04 | — | — | US | disclosed |