Malonic Acid

Malonic Acid

SCHEMBL5142880

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

nearest known ligand 0.91

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA4 P22748 4/20 0.91
CASP1 P29466 1/20 0.44
FFAR3 O14843 2/20 0.39
HDAC3 O15379 2/20 0.39
HDAC1 Q13547 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
LMNA P02545 2/20 0.38
CA1 P00915 3/20 0.36
FAHD1 Q6P587 1/20 0.36
CA2 P00918 2/20 0.35
BBOX1 O75936 1/20 0.35
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
LDHA P00338 1/20 0.33
SRR Q9GZT4 1/20 0.33

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
Malonic Acid SCHEMBL3190631 0.91
Malonic Acid SCHEMBL9184127 0.91
Malonic Acid SCHEMBL9571038 0.91
Malonic Acid SCHEMBL21878522 0.91 CA4 (0.91) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL21815638 0.91 CA4 (0.91) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL2475920 0.91 CA4 (0.91) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL9184622 0.91
Malonic Acid SCHEMBL21815790 0.91 CA4 (0.91) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL21878520 0.91
Malonic Acid SCHEMBL19714757 0.91 CA4 (0.91) CA4CASP1FFAR3HDAC3HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7291217-B2 Non-toxic corrosion-protection pigments based on rare earth elements UNIVERSITY OF DAYTON (US) 2007-11-06 US claimed
US-20040104377-A1 Non-toxic corrosion-protection pigments based on rare earth elements UNIVERSITY OF DAYTON 2004-06-03 US claimed
US-20040020568-A1 Non-toxic corrosion-protection conversion coats based on rare earth elements DAYTON, UNIVERSITY OF 2004-02-05 US claimed
US-20040016910-A1 Non-toxic corrosion-protection rinses and seals based on rare earth elements DAYTON, UNIVERSITY OF 2004-01-29 US claimed