Malonic Acid

Malonic Acid

SCHEMBL28291137

O=C(O)C(=O)O.O=C([O-])CC(=O)[O-].[Na+].[Na+]

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRM1SLC6A4

The experimentally established mechanism targets of Malonic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA4 P22748 5/20 0.79
CASP1 P29466 1/20 0.44
FFAR3 O14843 2/20 0.38
HDAC3 O15379 2/20 0.38
HDAC1 Q13547 2/20 0.38
HDAC2 Q92769 2/20 0.38
HDAC8 Q9BY41 2/20 0.38
FAHD1 Q6P587 1/20 0.38
OR51E2 Q9H255 2/20 0.37
LMNA P02545 1/20 0.37
CA2 P00918 1/20 0.36
CA1 P00915 2/20 0.35
LDHA P00338 1/20 0.35
SRR Q9GZT4 1/20 0.35
MAPK1 P28482 1/20 0.33
SLC13A3 Q8WWT9 1/20 0.33
EGLN1 Q9GZT9 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 SCHEMBL29456949 0.89 CA4 (1.00) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL107285 0.89
Malonic Acid SCHEMBL28920109 0.87 CA4 (0.59) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL28854452 0.85 CA4 (0.92) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL28253669 0.85 CA4 (0.92) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL28315716 0.85
Malonic Acid SCHEMBL106339 0.85
Malonic Acid SCHEMBL11307221 0.85 CA4 (0.92) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL10594878 0.85 CA4 (0.92) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL11136925 0.85 CA4 (0.92) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114660896-B Composition for forming silicon-containing resist underlayer film, pattern forming method, and silicon compound 信越化学工业株式会社 2024-06-11 CN disclosed
CN-109593032-A A kind of co-production of malonic acid and sodium oxalate 山西凯力德精细化学品科技有限公司 2019-04-09 CN disclosed