SCHEMBL6535441

SCHEMBL6535441

CCCCC(O)C(=O)[O-].CCCCC(O)C(=O)[O-].[Mg+2]

nearest known ligand 0.54

Known targets — ChEMBL curated mechanism

ATP4AATP4BGABBR1GABBR2HMGCR

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.54
GPR84 Q9NQS5 4/20 0.50
CA1 P00915 2/20 0.50
FFAR1 O14842 1/20 0.50
NFKB1 P19838 3/20 0.46
CYP3A4 P08684 2/20 0.46
TSHR P16473 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
CA4 P22748 1/20 0.42
MAPK1 P28482 1/20 0.41

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
SCHEMBL2483933 0.95 CA2 (0.54) CA2GPR84CA1FFAR1NFKB1
SCHEMBL30463176 0.95 CA2 (0.54) CA2GPR84CA1FFAR1NFKB1
SCHEMBL29800285 0.95 CA2 (0.54) CA2GPR84CA1FFAR1NFKB1
SCHEMBL29572976 0.95 CA2 (0.54) CA2GPR84CA1FFAR1NFKB1
Potassium Ion SCHEMBL29800416 0.95 CA2 (0.54) CA2GPR84CA1FFAR1NFKB1
SCHEMBL31257325 0.95 CA2 (0.54) CA2GPR84CA1FFAR1NFKB1
SCHEMBL6865427 0.95 CA2 (0.54) CA2GPR84CA1FFAR1NFKB1
SCHEMBL28427993 0.95 CA2 (0.59) CA2GPR84CA1FFAR1NFKB1
Ammonia Solution, Strong SCHEMBL8757949 0.93 CA2 (0.52) CA2GPR84CA1FFAR1NFKB1
SCHEMBL992521 0.91 GPR84 (0.63) CA2GPR84CA1FFAR1NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1224035-A4 METHOD AND APPARATUS FOR DEACIDIFICATION OF PAPERS AND BOOKS ZICHERMAN JOSEPH B (US) 2004-10-27 EP disclosed
US-6569399-B2 Reacting magnesium or reactive magnesium compounds with hydroxy compounds yielding magnesium alkoxides, followed by hydrolysis to form magesium hydroxide or magnesium oxide by calcining of magnesium hydroxide SASOL GERMANY GMBH (DE) 2003-05-27 US disclosed
EP-1224035-A1 METHOD AND APPARATUS FOR DEACIDIFICATION OF PAPERS AND BOOKS Zicherman, Joseph B. (US) 2002-07-24 EP disclosed
US-20020015677-A1 PROCESS FOR THE PREPARATION OF HIGH-PURITY MAGNESIUM HYDROXIDE AND MAGNESIUM OXIDE FROM MAGNESIUM ALKOXIDES SASOL GERMANY GMBH (DE) 2002-02-07 US disclosed
US-6214165-B1 FLUIDIZING ALKALINE PARTICLES WITH SOUND WAVES; IMMERSION OF LIGNOCELLULOSE MATERIAL Zicherman, Joseph 2001-04-10 US disclosed
WO-2001003855-A1 METHOD AND APPARATUS FOR DEACIDIFICATION OF PAPERS AND BOOKS ZICHERMAN, JOESEPH, B. (US) 2001-01-18 WO disclosed