⚠ 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 | |
|---|---|---|---|---|
| Propane SCHEMBL2524916 | 0.74 | — | — | |
| SCHEMBL1366337 | 0.74 | — | — | |
| SCHEMBL514899 | 0.70 | — | — | |
| SCHEMBL24690673 | 0.70 | — | — | |
| SCHEMBL384317 | 0.70 | — | — | |
| SCHEMBL6368053 | 0.70 | — | — | |
| Butane SCHEMBL2527135 | 0.70 | — | — | |
| SCHEMBL503012 | 0.70 | — | — | |
| N,N-Dimethylethanaminium SCHEMBL2146567 | 0.67 | TSHR (0.36) | — | |
| N,N-Dimethylethanaminium SCHEMBL16338 | 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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023150663-A1 | CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS | RETUNE PHARMA INC. (US) | 2023-08-10 | — | — | WO | disclosed |
| WO-2023070317-A1 | BIFUNCTIONAL NANOBODY BASED ON DC, AND CONSTRUCTION METHOD THEREFOR AND USE THEREOF | 江苏省农业科学院 | 2023-05-04 | — | — | WO | disclosed |
| US-11313048-B2 | Addition polymer for electrodepositable coating compositions | PRC-DESOTO INTERNATIONAL, INC. (US) | 2022-04-26 | — | — | US | disclosed |
| EP-3672614-B1 | ENGINEERED EXTRACELLULAR VESICLES AND USES THEREOF | CODIAK BIOSCIENCES INC (US) | 2021-10-06 | — | — | EP | disclosed |
| US-20210028488-A1 | POLYMER ELECTROLYTE AND MANUFACTURING METHOD THEREFOR | LG CHEM, LTD. (KR) | 2021-01-28 | — | — | US | disclosed |
| EP-2860178-B1 | P2X3 receptor antagonists for treatment of pain | MERCK SHARP & DOHME (US) | 2021-01-13 | — | — | EP | disclosed |
| US-20200407864-A1 | ADDITION POLYMER FOR ELECTRODEPOSITABLE COATING COMPOSITIONS | PRC-DESOTO INTERNATIONAL, INC. (US) | 2020-12-31 | — | — | US | disclosed |
| EP-3747870-A1 | PYRIDAZINOL COMPOUND, DERIVATIVE THEREOF, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF | Qingdao KingAgroot Chemical Compound Co., Ltd. (CN) | 2020-12-09 | — | — | EP | disclosed |
| WO-2020216708-A1 | COMPOUND AND AN ORGANIC SEMICONDUCTING LAYER, AN ORGANIC ELECTRONIC DEVICE AND A DISPLAY OR LIGHTING DEVICE COMPRISING THE SAME | NOVALED GMBH (DE) | 2020-10-29 | — | — | WO | disclosed |
| WO-2020212597-A1 | p16INK4a INHIBITOR FOR PREVENTING OR TREATING HUNTINGTON'S DISEASE | SORBONNE UNIVERSITE (FR) | 2020-10-22 | — | — | WO | disclosed |
| EP-1846419-B1 | Alkoxy-substituted thiazoloquinolines and thiazolonaphthyridines | 3M INNOVATIVE PROPERTIES CO (US) | 2014-04-16 | — | — | EP | disclosed |
| WO-2013088256-A1 | SUBSTITUTED PYRAZOLO[1,5-A] PYRIDINE AS TROPOMYOSIN RECEPTOR KINASE (TRK) INHIBITORS | DR. REDDY'S LABORATORIES LTD. (IN) | 2013-06-20 | — | — | WO | disclosed |
| US-20130005718-A1 | COMPOSITIONS AND METHODS OF TREATING CHRONIC PAIN BY ADMINISTERING PROPOFOL DERIVATIVES | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK | 2013-01-03 | — | — | US | disclosed |
| EP-2420493-A1 | HALOALKYLSULFONANILIDE DERIVATIVE | Nissan Chemical Industries, Ltd. (JP) | 2012-02-22 | — | — | EP | disclosed |
| US-20120029187-A1 | HALOALKYLSULFONANILIDE DERIVATIVE | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2012-02-02 | — | — | US | disclosed |
| EP-2336104-A1 | ORTHO-SUBSTITUTED HALOALKYLSULFONANILIDE DERIVATIVE AND HERBICIDE | Nissan Chemical Industries, Ltd. (JP) | 2011-06-22 | — | — | EP | disclosed |
| US-7291217-B2 | Non-toxic corrosion-protection pigments based on rare earth elements | UNIVERSITY OF DAYTON (US) | 2007-11-06 | — | — | US | disclosed |
| US-20040104377-A1 | Non-toxic corrosion-protection pigments based on rare earth elements | UNIVERSITY OF DAYTON | 2004-06-03 | — | — | US | disclosed |
| EP-0180188-B1 | A COMPOSITION FOR INCREASING THE ANTI-CANCER ACTIVITY OF AN ANTI-CANCER COMPOUND | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1992-04-15 | — | — | EP | disclosed |
| US-4180575-A | FUNGICIDES, BACTERICIDES | HOECHST AKTIENGESELLSCHAFT (DE) | 1979-12-25 | — | — | US | disclosed |