SCHEMBL164787

SCHEMBL164787

O=C(O)CN(CCN(Cc1ccccc1O)Cc1ccccc1O)CC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.53
TDP1 Q9NUW8 3/20 0.48
EYA2 O00167 1/20 0.48
APP P05067 1/20 0.48
ACE P12821 1/20 0.48
KDM4E B2RXH2 1/20 0.47
LMNA P02545 1/20 0.47
CHRM2 P08172 1/20 0.47
ADRA2A P08913 1/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
DRD1 P21728 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47
CYP2C19 P33261 1/20 0.47
ADRA1A P35348 1/20 0.47
DRD3 P35462 1/20 0.47
BLM P54132 1/20 0.47
PMP22 Q01453 1/20 0.47
SLC6A3 Q01959 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
Water SCHEMBL18962971 0.98 AKR1B1 (0.52) AKR1B1TDP1EYA2APPACE
SCHEMBL15864891 0.97 AKR1B1 (0.53) AKR1B1TDP1EYA2APPACE
SCHEMBL8966423 0.95 AKR1B1 (0.55) AKR1B1TDP1EYA2APPACE
SCHEMBL453848 0.95 AKR1B1 (0.55) AKR1B1TDP1EYA2APPACE
SCHEMBL29393657 0.95 AKR1B1 (0.55) AKR1B1TDP1EYA2APPACE
SCHEMBL17714025 0.94 AKR1B1 (0.47) AKR1B1TDP1EYA2APPACE
SCHEMBL1263592 0.93 AKR1B1 (0.50) AKR1B1TDP1EYA2APPACE
SCHEMBL23629774 0.93 AKR1B1 (0.53) AKR1B1TDP1EYA2APPACE
SCHEMBL1314141 0.93 AKR1B1 (0.53) AKR1B1TDP1EYA2APPACE
Water SCHEMBL505782 0.93 AKR1B1 (0.53) AKR1B1TDP1EYA2APPACE

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 550 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024138060-A2 METHODS AND MATERIALS FOR COMBINING BIOLOGICS WITH MULTIPLE CHELATORS MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2024-06-27 WO claimed
EP-4384559-A1 POLYMERIC CHELATORS CROSS-LINKED WITH HIGH MOLECULAR WEIGHT CROSS-LINKERS The University of Kansas (US) 2024-06-19 EP claimed
EP-4384558-A1 CROSS-LINKED POLYMERIC CHELATORS COMPOSITIONS AND USE THEREOF The University of Kansas (US) 2024-06-19 EP claimed
EP-4384557-A1 SMALL-PARTICLE SIZE POLYMERIC CHELATORS The University of Kansas (US) 2024-06-19 EP claimed
EP-4355376-A1 METHODS AND MATERIALS FOR COMBINING BIOLOGICS WITH MULTIPLE CHELATORS Mayo Foundation for Medical Education and Research (US) 2024-04-24 EP claimed
US-11963761-B2 Mediation of in vivo analyte signal degradation SENSEONICS, INCORPORATED (US) 2024-04-23 US claimed
EP-4337265-A2 FOLATE RECEPTOR-TARGETED CONJUGATES WITH BRUSH BORDER MEMBRANE ENZYME-CLEAVABLE LINKERS AND METHODS OF USE IN IMAGING AND TREATING CANCER Purdue Research Foundation (US) 2024-03-20 EP claimed
EP-3719105-B1 CLEANING FORMULATION FOR REMOVING RESIDUES ON SURFACES FUJIFILM ELECTRONIC MAT USA INC (US) 2023-09-27 EP claimed
WO-2023018987-A1 SMALL-PARTICLE SIZE POLYMERIC CHELATORS THE UNIVERSITY OF KANSAS (US) 2023-02-16 WO claimed
WO-2023018989-A1 CROSS-LINKED POLYMERIC CHELATORS COMPOSITIONS AND USE THEREOF THE UNIVERSITY OF KANSAS (US) 2023-02-16 WO claimed
EP-1755576-A1 ANTIMICROBIAL COMPOSITIONS AND METHODS FOR THEIR USE DERMCARE-VET PTY LTD (AU) 2007-02-28 EP claimed
EP-1017427-B1 USE OF A COMPOSITION COMPRISING A CHELATING AGENT AND AN ANTIMICROBIAL COMPOUND FOR THE TREATMENT OF BIOFILMS UNIV TEXAS (US) 2006-04-26 EP claimed
WO-2006023976-A2 FORMULATIONS AND METHODS FOR MODULATING SATIETY ROSENBERG MARK (US) 2006-03-02 WO claimed
WO-2005097094-A1 ANTIMICROBIAL COMPOSITIONS AND METHODS FOR THEIR USE DERMCARE-VET PTY LTD (AU) 2005-10-20 WO claimed
EP-1017427-A4 CHELATORS IN COMBINATION WITH BIOCIDES: TREATMENT OF MICROBIALLY INDUCED BIOFILM AND CORROSION UNIV TEXAS (US) 2001-09-12 EP claimed
US-6267979-B1 PROVIDINY AQUEOUS SYSTEM FORMULATION COMPRISING CHELATING AGENT, AN ANTIMICROBIAL TO CONTROL GROWTH OF MICROORGANISMS WAKE FOREST UNIVERSITY 2001-07-31 US claimed
US-6242492-B1 TRANSFUSIONAL IRON OVERLOAD, THALASSEMIA, SICKLE CELL ANEMIA, BLOOD DISORDERS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2001-06-05 US claimed
EP-1017427-A1 CHELATORS IN COMBINATION WITH BIOCIDES: TREATMENT OF MICROBIALLY INDUCED BIOFILM AND CORROSION THE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2000-07-12 EP claimed
EP-0791671-B1 Surface treating agent for copper or copper alloy SHIKOKU CHEM (JP) 1999-06-16 EP claimed
WO-1999010017-A1 CHELATORS IN COMBINATION WITH BIOCIDES: TREATMENT OF MICROBIALLY INDUCED BIOFILM AND CORROSION BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1999-03-04 WO claimed