SCHEMBL1324316

SCHEMBL1324316

O=C([O-])CC(O)(O)C(=O)[O-].O=C([O-])CC(O)(O)C(=O)[O-].O=C([O-])CC(O)(O)C(=O)[O-].[Fe+3].[Fe+3]

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA4 P22748 3/20 0.62
CASP1 P29466 1/20 0.32

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
SCHEMBL1324317 0.94 CA4 (0.55) CA4CASP1
SCHEMBL7603816 0.94 CA4 (0.62) CA4CASP1
SCHEMBL10445802 0.94 CA4 (0.55) CA4CASP1
SCHEMBL7969654 0.92 CA4 (0.59) CA4CASP1
Citric Acid SCHEMBL362816 0.82 CA4 (0.89) CA4CASP1
Citric Acid SCHEMBL1231331 0.82 CA4 (0.89) CA4CASP1
Citric Acid SCHEMBL693006 0.82 CA4 (0.89) CA4CASP1
Citric Acid SCHEMBL18131942 0.82 CA4 (0.89) CA4CASP1
Citric Acid SCHEMBL31633755 0.80 CA4 (0.84) CA4CASP1
Citric Acid SCHEMBL31413937 0.80 CA4 (0.84) CA4CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2320884-B1 PHOSPHATE BINDING MATERIALS AND THEIR USES MEDICAL RES COUNCIL (GB) 2016-07-13 EP disclosed
EP-2125847-B1 LIGAND MODIFIED POLY OXO-HYDROXY METAL ION MATERIALS, THEIR USES AND PROCESSES FOR THEIR PREPARATION MEDICAL RES COUNCIL (GB) 2015-06-17 EP disclosed
US-8058462-B2 Adding ligand then alkalinity agent to metal salt solution; precipitating such as iron hydroxide maleate; micronutrients MEDICAL RESEARCH COUNCIL (GB) 2011-11-15 US disclosed
EP-2320884-A2 PHOSPHATE BINDING MATERIALS AND THEIR USES Medical Research Council Technology (GB) 2011-05-18 EP disclosed
US-7943664-B2 Phosphate binding materials and their uses MEDICAL RESEARCH COUNCIL (GB) 2011-05-17 US disclosed
WO-2010015827-A2 PHOSPHATE BINDING MATERIALS AND THEIR USES MEDICAL RESEARCH COUNCIL (GB) 2010-02-11 WO disclosed
US-20100032374-A1 PHOSPHATE BINDING MATERIALS AND THEIR USES MEDICAL RESEARCH COUNCIL (GB) 2010-02-11 US disclosed
US-20080188555-A1 LIGAND MODIFIED POLY OXO-HYDROXY METAL ION MATERIALS, THEIR USES AND PROCESSES FOR THEIR PREPARATION UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2008-08-07 US disclosed