Malonic Acid

Malonic Acid

SCHEMBL11024941

CCc1cccc2c1C(=O)N(CC)C2=O.O=C(O)CC(=O)O

nearest known ligand 0.47

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1B1 Q16678 4/20 0.47
ANPEP P15144 1/20 0.43
DPP4 P27487 1/20 0.43
POLB P06746 1/20 0.43
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
MAPT P10636 4/20 0.43
KDM4E B2RXH2 3/20 0.43
PABPC1 P11940 1/20 0.43
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
ALDH1A1 P00352 5/20 0.41
LMNA P02545 1/20 0.41
USP2 O75604 1/20 0.41
ATM Q13315 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
HPGD P15428 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CYP1A2 P05177 1/20 0.41

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
SCHEMBL4540078 0.87 CYP1B1 (0.49) CYP1B1ANPEPDPP4POLBMEN1
SCHEMBL6550873 0.76 ANPEP (0.49) ANPEPDPP4MEN1KMT2AMAPT
SCHEMBL13671572 0.75 MEN1 (0.43) ANPEPDPP4MEN1KMT2AMAPT
SCHEMBL4379341 0.75 CYP1B1 (0.49) CYP1B1ANPEPDPP4POLBMEN1
SCHEMBL12235610 0.74 ANPEP (0.58) CYP1B1ANPEPDPP4POLBMEN1
SCHEMBL8362674 0.73 NR1H2 (0.54) CYP1B1MEN1KMT2AMAPTKDM4E
SCHEMBL4370950 0.73 MEN1 (0.61) CYP1B1DPP4POLBMEN1KMT2A
SCHEMBL12235632 0.73 CYP1B1 (0.58) CYP1B1DPP4MEN1KMT2AMAPT
SCHEMBL17510004 0.71 CYP1B1 (0.68) CYP1B1POLBMEN1KMT2AMAPT
SCHEMBL10451189 0.71 KDM4E (0.59) CYP1B1MEN1KMT2AMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0042440-B1 FIRE RETARDANT ORGANIC HIGH MOLECULAR COMPOSITION ACOME, SOCIETE COOPERATIVE DE TRAVAILLEURS (FR) 1985-03-27 EP disclosed
US-4410648-A CYCLIC ANHYDRIDE OR IMIDE, INORGANIC POWDER, POLYUNSATURATED MONOMER DAINICHI-NIPPON CABLES, LTD. (JP) 1983-10-18 US disclosed
EP-0042440-A1 FIRE RETARDANT ORGANIC HIGH MOLECULAR COMPOSITION ACOME, SOCIETE COOPERATIVE DE TRAVAILLEURS (FR) 1981-12-30 EP disclosed