Malonic Acid

Malonic Acid

SCHEMBL7939336

C=CC(=O)OC.O=C(O)CC(=O)O

nearest known ligand 0.45

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Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.45
SRR Q9GZT4 1/20 0.45
HCAR2 Q8TDS4 2/20 0.43
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
HSD17B10 Q99714 2/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 9/20 0.41
HPGD P15428 1/20 0.40
ALDH1A1 P00352 8/20 0.39
TP53 P04637 3/20 0.39
HIF1A Q16665 3/20 0.39
CYP3A4 P08684 2/20 0.39
LMNA P02545 1/20 0.36
MAPK1 P28482 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.33
THRB P10828 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 SCHEMBL28190604 0.98 LDHA (0.43) LDHASRRHCAR2KEAP1NFE2L2
Acrylic Acid Methyl Ester SCHEMBL14892886 0.89
Acetoacetic Acid SCHEMBL28115416 0.89 MGAM (0.41) LDHASRRHCAR2KEAP1NFE2L2
Succinic Acid SCHEMBL27421017 0.88 TSHR (0.43) HCAR2KEAP1NFE2L2HSD17B10ALOX15
Acrylic Acid Methyl Ester SCHEMBL28304536 0.88 HCAR2 (0.42) HCAR2KEAP1NFE2L2HSD17B10ALOX15
Acrylic Acid Methyl Ester SCHEMBL27473540 0.88 TSHR (0.43) HCAR2KEAP1NFE2L2HSD17B10ALOX15
Succinic Acid SCHEMBL28054034 0.88 TSHR (0.43) HCAR2KEAP1NFE2L2HSD17B10ALOX15
Acrylic Acid Methyl Ester SCHEMBL27557604 0.88 FFAR3 (0.48) HCAR2KEAP1NFE2L2HSD17B10ALOX15
Acrylic Acid Methyl Ester SCHEMBL21715435 0.87 HCAR2 (0.50) HCAR2KEAP1NFE2L2HSD17B10ALOX15
Acrylic Acid Methyl Ester SCHEMBL29240015 0.87 HCAR2 (0.50) HCAR2KEAP1NFE2L2HSD17B10ALOX15

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-0618956-B1 POLYFUNCTIONAL MICHAEL ADDITION PRODUCTS AND REFRIGERATION COMPOSITIONS CONTAINING SUCH PRODUCTS ALBEMARLE CORP (US) 2001-07-11 EP disclosed
US-5683618-A MIXTURES OF ESTERS, KETONES OR NITRILES FOR LUBRICANTS FOR STABILITY ALBEMARLE CORPORATION (US) 1997-11-04 US disclosed
US-5569779-A ESTER OILS; LUBRICANTS ALBEMARLE CORPORATION (US) 1996-10-29 US disclosed
US-5430177-A Polyfunctional Michael addition products ALBEMARLE CORPORATION (US) 1995-07-04 US disclosed
US-5391312-A Seal-swell ester oils to counteract seal shrinkage ALBEMARLE CORPORTION (US) 1995-02-21 US disclosed
EP-0618956-A1 POLYFUNCTIONAL MICHAEL ADDITION PRODUCTS AND REFRIGERATION COMPOSITIONS CONTAINING SUCH PRODUCTS ALBEMARLE CORPORATION (US) 1994-10-12 EP disclosed
WO-1993013188-A1 POLYFUNCTIONAL MICHAEL ADDITION PRODUCTS AND REFRIGERATION COMPOSITIONS CONTAINING SUCH PRODUCTS ETHYL CORPORATION (US) 1993-07-08 WO disclosed