Oxalic Acid

Oxalic Acid

SCHEMBL6313261

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

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRM1SLC6A4

The experimentally established mechanism targets of Oxalic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.39
ALOX15 P16050 1/20 0.35
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
LMNA P02545 1/20 0.33
ALDH1A1 P00352 2/20 0.32
GLA P06280 1/20 0.32
TSHR P16473 1/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
MMP8 P22894 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
NPC1 O15118 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
Oxalic Acid SCHEMBL7866905 1.00 FFAR3 (0.39) FFAR3ALOX15HDAC3HDAC1HDAC2
Acetic Acid SCHEMBL5068220 0.87 FFAR3 (0.47) FFAR3HDAC3HDAC1HDAC2HDAC8
Acetic Acid SCHEMBL1546072 0.84 FFAR3 (0.44) FFAR3ALOX15HDAC3HDAC1HDAC2
SCHEMBL57247 0.82
SCHEMBL3669514 0.82
Glycolic Acid SCHEMBL5551767 0.81 FFAR3 (0.42) FFAR3ALOX15HDAC3HDAC1HDAC2
Bicarbonate SCHEMBL10423661 0.81 FFAR3 (0.35) FFAR3HDAC3HDAC1HDAC2HDAC8
Urea SCHEMBL28780726 0.80 LMNA (0.40) FFAR3ALOX15LMNAALDH1A1GLA
SCHEMBL11432492 0.78
Water SCHEMBL3372529 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6841061-B1 Antigelling agent for hydrocarbon mixture containing conjugated diene and method of preventing clogging of apparatus for separating and purifying the mixture ZEON CORPORATION (JP) 2005-01-11 US disclosed
US-6770222-B1 HYDROXYLAMINES AND PHOSPHORUS CONTAINING COMPOUND NIPPON ZEON CO., LTD. (JP) 2004-08-03 US disclosed
EP-1184444-A1 ANTIGELLING AGENT FOR HYDROCARBON MIXTURE CONTAINING CONJUGATED DIENE AND METHOD OF PREVENTING CLOGGING OF APPARATUS FOR SEPARATING AND PURIFYING THE MIXTURE Nippon Zeon Co., Ltd. (JP) 2002-03-06 EP disclosed
EP-1061059-A1 POLYMERIZATION-INHIBITING COMPOSITION, POLYMERIZATION INHIBITOR AND METHOD FOR INHIBITING POLYMERIZATION NIPPON ZEON CO., LTD. (JP) 2000-12-20 EP disclosed