Edetic Acid

Edetic Acid

SCHEMBL1837798

COCCNCCOC.COCCNCCOC.COCCNCCOC.COCCNCCOC.O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.54
EYA2 O00167 1/20 0.54
APP P05067 1/20 0.54
ACE P12821 1/20 0.54
KDM4E B2RXH2 9/20 0.52
BLM P54132 2/20 0.52
PMP22 Q01453 2/20 0.52
TSHR P16473 2/20 0.52
LMNA P02545 1/20 0.52
CHRM2 P08172 1/20 0.52
ADRA2A P08913 1/20 0.52
ALOX15 P16050 1/20 0.52
DRD1 P21728 1/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A4 P31645 1/20 0.52
CYP2C19 P33261 1/20 0.52
ADRA1A P35348 1/20 0.52
DRD3 P35462 1/20 0.52
SLC6A3 Q01959 1/20 0.52
HRH3 Q9Y5N1 1/20 0.52

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
SCHEMBL8089255 0.84 TDP1 (0.48) TDP1EYA2APPACEKDM4E
SCHEMBL8103783 0.82 TDP1 (0.50) TDP1EYA2APPACEKDM4E
Versetamide SCHEMBL2109367 0.82 TDP1 (0.50) TDP1EYA2APPACEKDM4E
SCHEMBL562838 0.81 BLM (0.64) TDP1EYA2APPACEKDM4E
Versetamide SCHEMBL23202642 0.81 TDP1 (0.48) TDP1EYA2APPACEKDM4E
Versetamide SCHEMBL15844631 0.81 TDP1 (0.48) TDP1EYA2APPACEKDM4E
Versetamide SCHEMBL17848990 0.80 TDP1 (0.47) TDP1EYA2APPACEKDM4E
Bicarbonate SCHEMBL1834592 0.79 KDM4E (0.46) TDP1KDM4ETSHRMAPK1L3MBTL1
Bicarbonate SCHEMBL1831706 0.79 KDM4E (0.46) TDP1KDM4ETSHRMAPK1L3MBTL1
SCHEMBL16390501 0.78 TDP1 (0.54) TDP1EYA2APPACEKDM4E

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 US claimed
US-9328220-B2 Liquids INNOVIA FILMS LIMITED (GB) 2016-05-03 US disclosed
US-8992798-B2 Liquids INNOVIA FILMS LIMITED (GB) 2015-03-31 US disclosed
US-8784686-B2 Liquids INNOVIA FILMS LIMITED (GB) 2014-07-22 US disclosed
US-20140187684-A1 LIQUIDS INNOVIA FILMS LIMITED (GB) 2014-07-03 US disclosed
US-20110257433-A1 LIQUIDS THE UNIVERSITY OF YORK (GB) 2011-10-20 US disclosed
EP-2322497-A1 Ionic liquids comprising nitrogen containing cations Innovia Films Limited (GB) 2011-05-18 EP disclosed
US-20100311998-A1 CHELATING AGENT BASED IONIC LIQUIDS, A PROCESS TO PREPARE THEM, AND THEIR USE AKZO NOBEL N.V. (NL) 2010-12-09 US disclosed
EP-2170808-A2 CHELATING AGENT BASED IONIC LIQUIDS, A PROCESS TO PREPARE THEM, AND THEIR USE Akzo Nobel N.V. (NL) 2010-04-07 EP disclosed
WO-2009016235-A2 CHELATING AGENT BASED IONIC LIQUIDS, A PROCESS TO PREPARE THEM, AND THEIR USE AKZO NOBEL N.V. (NL) 2009-02-05 WO disclosed
US-20080221361-A1 Ionic Liquids BIONIQS LIMITED (GB) 2008-09-11 US disclosed
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 US disclosed