⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7167963 | 0.86 | — | — | |
| SCHEMBL620009 | 0.77 | — | — | |
| SCHEMBL82843 | 0.70 | — | — | |
| SCHEMBL617265 | 0.69 | CYP3A4 (0.32) | — | |
| SCHEMBL87312 | 0.69 | CYP3A4 (0.32) | — | |
| SCHEMBL4721663 | 0.68 | — | — | |
| SCHEMBL9572806 | 0.67 | — | — | |
| SCHEMBL298741 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL572769 | 0.67 | CYP3A4 (0.31) | — | |
| Iodide SCHEMBL2341578 | 0.67 | CYP3A4 (0.31) | — |
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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3297988-A1 | CYCLIC QUATERNARY AMMONIUM SALTS AS FUEL OR LUBRICANT ADDITIVES | Innospec Limited (GB) | 2018-03-28 | — | — | EP | disclosed |
| WO-2017017454-A1 | CYCLIC QUATERNARY AMMONIUM SALTS AS FUEL OR LUBRICANT ADDITIVES | INNOSPEC LIMITED (GB) | 2017-02-02 | — | — | WO | disclosed |
| US-7354568-B1 | Magnetic resonance imaging agents for the detection of physiological agents | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2008-04-08 | — | — | US | disclosed |
| EP-1558137-A2 | FUNCTIONAL MRI AGENTS FOR CANCER IMAGING | Research Corporation Technologies (US) | 2005-08-03 | — | — | EP | disclosed |
| US-20050002866-A1 | Magnetic resonance imaging agents for the detection of physiological agents | NATIONAL INSTITUTES OF HEALTH | 2005-01-06 | — | — | US | disclosed |
| US-20040170563-A1 | Magnetic resonance imaging agents for the delivery of therapeutic agents | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2004-09-02 | — | — | US | disclosed |
| US-6770261-B2 | COMPRISES CHELATED/PARAMAGNETIC GADOLINIUM COMPLEX COMPRISING BLOCKING MOIETY COVALENTLY ATTACTED TO INTERACT WITH THE TARGE SUBSTANCE SUCH THAT EXHANGE OF WATER IN COORDINATION SITES IS ALTERED; BIOCOMPATABILITY | RESEARCH CORPORATION TECHNOLOGIES | 2004-08-03 | — | — | US | disclosed |
| US-20040146463-A1 | Functional MRI agents for cancer imaging | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2004-07-29 | — | — | US | disclosed |
| WO-2004037210-A2 | FUNCTIONAL MRI AGENTS FOR CANCER IMAGING | RESEARCH CORPORATION TECHNOLOGIES (US) | 2004-05-06 | — | — | WO | disclosed |
| US-6713045-B1 | COMPOSITION COMPRISING GADOLINIUM ION BOUND TO CHELATOR AND HAVING COORDINATION ATOMS IN AT LEAST 7 COORDINATION SITES, COVALENTLY ATTACHED BLOCKING MOIETY HINDERING RAPID EXCHANGE OF WATER IN REMAINING COORDINATION SITES, TARGETING MOIETY | RESEARCH CORPORATION TECHNOLOGIES, INC. | 2004-03-30 | — | — | US | disclosed |
| US-5980862-A | A CONTRAST AGENTS COMPRISING A GADOLINIUM ION BOUND TO A CHELATOR AND A BLOCKING MOIETY COVALENTLY ATTACHED TO CHELATOR WHICH HINDERING THE RAPID EXCHANGE OF WATER; FOR USE IN DETECTING PHYSIOLOGICAL SIGNALS OR SUBSTANCES | RESEARCH CORPORATION TECHNOLOGIES (US) | 1999-11-09 | — | — | US | disclosed |
| WO-1999025389-A9 | MAGNETIC RESONANCE IMAGING AGENTS FOR THE DETECTION OF PHYSIOLOGICAL AGENTS | RES CORP TECHNOLOGIES INC (US) | 1999-08-26 | — | — | WO | disclosed |
| WO-1999025389-A2 | MAGNETIC RESONANCE IMAGING AGENTS FOR THE DETECTION OF PHYSIOLOGICAL AGENTS | RESEARCH CORPORATION TECHNOLOGIES, INC. (US) | 1999-05-27 | — | — | WO | disclosed |
| EP-0831928-A2 | MAGNETIC RESONANCE IMAGING AGENTS FOR THE DETECTION OF PHYSIOLOGICAL AGENTS | Research Corporation Technologies, Inc (US) | 1998-04-01 | — | — | EP | disclosed |
| US-5707605-A | Magnetic resonance imaging agents for the detection of physiological agents | RESEARCH CORPORATION TECHNOLOGIES (US) | 1998-01-13 | — | — | US | disclosed |
| WO-1996038184-A2 | MAGNETIC RESONANCE IMAGING AGENTS FOR THE DETECTION OF PHYSIOLOGICAL AGENTS | RESEARCH CORPORATION TECHNOLOGIES, INC. (US) | 1996-12-05 | — | — | WO | disclosed |
| US-4191771-A | NARCOTIC ANTAGONISTS | ELI LILLY AND COMPANY (US) | 1980-03-04 | — | — | US | disclosed |
| US-4175197-A | 1,3,4-Trisubstituted-4-aryl-1,4,5,6-tetra-hydropyridines | ELI LILLY AND COMPANY (US) | 1979-11-20 | — | — | US | disclosed |
| US-4115400-A | 1-Azoniabicyclo[3.1.0]hexanes | ELI LILLY AND COMPANY (US) | 1978-09-19 | — | — | US | disclosed |
| US-4081450-A | 1,3,4-Trisubstituted-4-arylpiperidines and their preparation | ELI LILLY AND COMPANY (US) | 1978-03-28 | — | — | US | disclosed |