⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15094359 | 0.80 | — | — | |
| SCHEMBL351538 | 0.78 | ADRA2A (0.34) | — | |
| SCHEMBL329002 | 0.78 | ADRA2A (0.34) | — | |
| SCHEMBL25266 | 0.74 | — | — | |
| SCHEMBL9831910 | 0.74 | — | — | |
| SCHEMBL7325932 | 0.74 | — | — | |
| SCHEMBL353044 | 0.74 | ADRA2A (0.32) | — | |
| SCHEMBL5108997 | 0.74 | — | — | |
| SCHEMBL14917574 | 0.74 | ADRA2A (0.33) | — | |
| SCHEMBL4105812 | 0.74 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113354811-B | Oxazoline polymer with side chain containing amino and/or hydroxyl, preparation method and application thereof | 华东理工大学 | 2024-05-07 | — | — | CN | disclosed |
| CN-109563045-B | Pd (II) -catalysed enantioselective beta-methylene C (sp) 3 ) -H bond activation | 斯克里普斯研究学院 | 2022-08-23 | — | — | CN | disclosed |
| US-11186563-B2 | Pd(II)-catalyzed enantioselective β-methylene C(sp3)—H bond activation | THE SCRIPPS RESEARCH INSTITUTE (US) | 2021-11-30 | — | — | US | disclosed |
| CN-113354811-A | Oxazoline polymer with side chain containing amino and/or hydroxyl, preparation method and application thereof | 华东理工大学 | 2021-09-07 | — | — | CN | disclosed |
| US-20190315710-A1 | Pd(II)-catalyzed Enantioselective Beta-Methylene C(sp3)–H Bond Activation | THE SCRIPPS RESEARCH INSTITUTE | 2019-10-17 | — | — | US | disclosed |
| EP-3440056-A2 | PD(II)-CATALYZED ENANTIOSELECTIVE BETA-METHYLENE C(SP3)-H BOND ACTIVATION | The Scripps Research Institute (US) | 2019-02-13 | — | — | EP | disclosed |
| WO-2017165304-A2 | Pd(II)-CATALYZED ENANTIOSELECTIVE BETA-METHYLENE C(sp3)-H BOND ACTIVATION | THE SCRIPPS RESEARCH INSTITUTE (US) | 2017-09-28 | — | — | WO | disclosed |
| CN-1835909-A | Process for the preparation of aromatic amines | AVECIA LTD (GB) | 2006-09-20 | — | — | CN | disclosed |
| US-6451727-B2 | PREPARED FROM CHIRAL AMINO ALCOHOLS; SUITABLE FOR ASSYMETRIC CATALYSIS; FOR TRANSFER HYDROGENATION OF KETONES AND IMINES; ENANTIOMORPHS; PURITY; EFFICIENCY | THE PENN STATE RESEARCH FOUNDATION | 2002-09-17 | — | — | US | disclosed |
| US-20010044546-A1 | Prepared from chiral amino alcohols; suitable for assymetric catalysis; for transfer hydrogenation of ketones and imines; enantiomorphs; purity; efficiency | THE PENN STATE RESEARCH FOUNDATION | 2001-11-22 | — | — | US | disclosed |
| US-6255493-B1 | REACTING IMIDATE ESTER WITH CHIRAL ALCOHOL IN PRESENCE OF TRANSITION METAL CATALYST TO FORM BIS(4-(R)-PHENYLOXAZOLIN-2-YL-METHYL)AMINE LIGANDS; USE TO MAKE RUTHENIUM CATALYST FOR TRANSFER HYDROGENATION | THE PENN STATE RESEARCH FOUNDATION | 2001-07-03 | — | — | US | disclosed |
| CN-1278801-A | Transition metal-catalyzed reactions based on chiral amine oxazolinyl ligands | UNIV PENNSYLVANIA (US) | 2001-01-03 | — | — | CN | disclosed |
| EP-1030849-A1 | TRANSITION METAL-CATALYZED REACTIONS BASED ON CHIRAL AMINE OXAZOLINYL LIGANDS | The Pennsylvania State University (US) | 2000-08-30 | — | — | EP | disclosed |
| WO-1999024410-A1 | TRANSITION METAL-CATALYZED REACTIONS BASED ON CHIRAL AMINE OXAZOLINYL LIGANDS | THE PENN STATE RESEARCH FOUNDATION (US) | 1999-05-20 | — | — | WO | disclosed |