Malonic Acid

Malonic Acid

SCHEMBL8009049

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

nearest known ligand 0.67

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.67
LMNA P02545 2/20 0.67
HSD17B10 Q99714 1/20 0.67
LDHA P00338 1/20 0.60
SRR Q9GZT4 1/20 0.60
TSHR P16473 7/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 5/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
FGFR4 P22455 1/20 0.37
CYP2D6 P10635 2/20 0.35
ABCC4 O15439 1/20 0.35
MAPT P10636 1/20 0.35
EGLN1 Q9GZT9 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
BLM P54132 1/20 0.33
SLC6A3 Q01959 1/20 0.33
TP53 P04637 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 SCHEMBL30656887 1.00 ALOX15 (0.67) ALOX15LMNAHSD17B10LDHASRR
Acrylic Acid SCHEMBL8591892 0.83 ALOX15 (0.62) ALOX15LMNAHSD17B10LDHASRR
Acetoacetic Acid SCHEMBL7747946 0.83 ALOX15 (0.56) ALOX15LMNAHSD17B10LDHASRR
Malonic Acid SCHEMBL17985762 0.83 LDHA (0.64) ALOX15LMNAHSD17B10LDHASRR
Acrylic Acid SCHEMBL11652408 0.82 LMNA (1.00) ALOX15LMNAHSD17B10TSHRALDH1A1
Acrylic Acid SCHEMBL8580358 0.82 LMNA (1.00) ALOX15LMNAHSD17B10TSHRALDH1A1
Acrylic Acid SCHEMBL5065665 0.82 LMNA (1.00) ALOX15LMNAHSD17B10TSHRALDH1A1
Acrylic Acid SCHEMBL7706117 0.82 LMNA (1.00) ALOX15LMNAHSD17B10TSHRALDH1A1
Acrylic Acid SCHEMBL10482239 0.82 LMNA (1.00) ALOX15LMNAHSD17B10TSHRALDH1A1
Acrylic Acid SCHEMBL4371336 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104231013-B A kind of gastrodine Glehnilae and preparation method thereof and application 上海现代哈森(商丘)药业有限公司 2016-06-29 CN claimed
CN-104231013-A Gastrodin ferulate compound and preparation method and application of gastrodin ferulate compound SHANGHAI MODERN HASEN SHANGQIU PHARMACEUTICAL CO LTD 2014-12-24 CN claimed
CN-104231013-B A kind of gastrodine Glehnilae and preparation method thereof and application 上海现代哈森(商丘)药业有限公司 2016-06-29 CN disclosed
CN-104231013-A Gastrodin ferulate compound and preparation method and application of gastrodin ferulate compound SHANGHAI MODERN HASEN SHANGQIU PHARMACEUTICAL CO LTD 2014-12-24 CN disclosed
WO-2000020926-A9 IONIZATION RADIATION IMAGEABLE PHOTOPOLYMER COMPOSITIONS DU PONT (US) 2000-09-14 WO disclosed