Malonic Acid

Malonic Acid

SCHEMBL4421965

N.N.O=C(O)CC(=O)O.OCC(CO)CO

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.56
SRR Q9GZT4 1/20 0.56
OR51E2 Q9H255 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP2D6 P10635 2/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
SLC22A6 Q4U2R8 1/20 0.32
LMNA P02545 1/20 0.32
ALKBH5 Q6P6C2 1/20 0.32
SUCNR1 Q9BXA5 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
TGFBR1 P36897 1/20 0.31
TSHR P16473 3/20 0.31
KDM4E B2RXH2 1/20 0.31
CAMK2A Q9UQM7 1/20 0.30
FFAR3 O14843 1/20 0.30
GLRA1 P23415 1/20 0.30
SLC6A9 P48067 1/20 0.30
FNTA P49354 1/20 0.30

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 SCHEMBL4421962 1.00 LDHA (0.56) LDHASRROR51E2TDP1CYP2D6
Malonic Acid SCHEMBL558069 0.79
Malonic Acid SCHEMBL558068 0.79
Malonic Acid SCHEMBL27615143 0.75
Ammonia Solution, Strong SCHEMBL728637 0.75
Malonic Acid SCHEMBL1332554 0.75
Malonic Acid SCHEMBL336 0.75
Malonic Acid SCHEMBL1332587 0.75
Malonic Acid SCHEMBL22124621 0.75 LMNA (0.56) LDHASRROR51E2SLC22A6LMNA
Malonic Acid SCHEMBL3358611 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1603527-B1 TERPENOID FRAGRANCE COMPONENTS STABILIZED WITH MALONIC ACID SALTS UNILEVER PLC (GB) 2009-02-04 EP disclosed
EP-1603527-A1 TERPENOID FRAGRANCE COMPONENTS STABILIZED WITH MALONIC ACID SALTS UNILEVER PLC (GB) 2005-12-14 EP disclosed
EP-1509197-A1 COSMETIC COMPOSITIONS CONTAINING SALTS OF MALONIC ACID UNILEVER PLC (GB) 2005-03-02 EP disclosed
US-20040202689-A1 Terpenoid fragrance components stabilized with malonic acid salts UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2004-10-14 US disclosed
WO-2004082652-A1 TERPENOID FRAGRANCE COMPONENTS STABILIZED WITH MALONIC ACID SALTS UNILEVER PLC (GB) 2004-09-30 WO disclosed
US-20040185073-A1 Cosmetic compositions containing salts of malonic acid UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2004-09-23 US disclosed
WO-2003099254-A1 COSMETIC COMPOSITIONS CONTAINING SALTS OF MALONIC ACID UNILEVER PLC (GB) 2003-12-04 WO disclosed