Malonic Acid

Malonic Acid

SCHEMBL5709272

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nearest known ligand 0.67

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Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA4 P22748 2/20 0.67
CASP1 P29466 1/20 0.35
FFAR3 O14843 2/20 0.32
HDAC3 O15379 2/20 0.32
HDAC1 Q13547 2/20 0.32
HDAC2 Q92769 2/20 0.32
HDAC8 Q9BY41 2/20 0.32
LMNA P02545 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 SCHEMBL5709275 0.93 CA4 (0.67) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL1925806 0.86
Malonic Acid SCHEMBL5142880 0.78 CA4 (0.91) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL9571038 0.78
Malonic Acid SCHEMBL19714757 0.78 CA4 (0.91) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL2475920 0.78 CA4 (0.91) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL21815638 0.78 CA4 (0.91) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL21815790 0.78 CA4 (0.91) CA4CASP1FFAR3HDAC3HDAC1
Malonic Acid SCHEMBL21878520 0.78
Malonic Acid SCHEMBL3190631 0.78

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
US-20150173847-A1 IMAGING MARKER AND UTILIZATION THEREOF RIKEN (JP) 2015-06-25 US disclosed
US-7153377-B2 Method of separating admixed contaminants from superalloy metal powder R. J. LEE GROUP, INC. (US) 2006-12-26 US disclosed
EP-1711640-A2 METHOD OF SEPARATING ADMIXED CONTAMINANTS FROM SUPERALLOY METAL POWDER RJ Lee Group Inc. (US) 2006-10-18 EP disclosed
WO-2005074559-A2 METHOD OF SEPARATING ADMIXED CONTAMINANTS FROM SUPERALLOY METAL POWDER RJ LEE GROUP, INC. (US) 2005-08-18 WO disclosed
US-20050167003-A1 Method of separating admixed contaminants from superalloy metal powder CADENCE BANK, N.A. 2005-08-04 US disclosed