Malonic Acid

Malonic Acid

SCHEMBL161793

CN1CCc2ccccc2C[C@@H]1Cl.O=C(O)CC(=O)O

nearest known ligand 0.43

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 5/20 0.43
OPRK1 P41145 5/20 0.43
KDM4E B2RXH2 3/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HDAC1 Q13547 2/20 0.41
HDAC6 Q9UBN7 1/20 0.41
NOTUM Q6P988 2/20 0.40
OPRL1 P41146 1/20 0.40
DRD5 P21918 1/20 0.40
PRCP P42785 1/20 0.40
MTNR1A P48039 3/20 0.40
MTNR1B P49286 3/20 0.40
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
OPRD1 P41143 1/20 0.39

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
Glycolic Acid SCHEMBL158529 0.91 KDM4E (0.41) OPRM1OPRK1KDM4EMEN1POLB
Adipic Acid SCHEMBL160638 0.89 KDM4E (0.46) OPRM1OPRK1KDM4EMEN1POLB
SCHEMBL162104 0.86 DRD2 (0.48) DRD5PRCP
SCHEMBL164258 0.85 LMNA (0.42) OPRM1OPRK1NOTUMDRD5PRCP
Sulfuric Acid SCHEMBL163037 0.84 LMNA (0.47) OPRM1OPRK1KDM4ENOTUMDRD5
Nitric Acid SCHEMBL161325 0.81 DRD1 (0.41) OPRM1OPRK1MEN1POLBMAPT
Malonic Acid SCHEMBL160931 0.72 HDAC1 (0.50) KDM4EMEN1POLBMAPTKMT2A
Succinic Acid SCHEMBL170445 0.70 DRD2 (0.64) KDM4EMEN1POLBMAPTKMT2A
SCHEMBL5332110 0.68 OPRM1 (0.57) OPRM1OPRK1KDM4EMEN1POLB
SCHEMBL17662597 0.68 DRD2 (0.55) DRD5PRCP

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
EP-2611781-A1 FAST-DISSOLVE DOSAGE FORMS OF 5-HT2C AGONISTS Arena Pharmaceuticals, Inc. (US) 2013-07-10 EP claimed
WO-2012030951-A1 FAST-DISSOLVE DOSAGE FORMS OF 5-HT2C AGONISTS ARENA PHARMACEUTICALS, INC. (US) 2012-03-08 WO claimed