Oxalic Acid

Oxalic Acid

SCHEMBL175690

O=C(O)C(=O)O.O=C([O-])CCC(F)(F)F.OB(O)O.[Li+]

nearest known ligand 0.31

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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 5)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.31
HDAC3 O15379 2/20 0.31
HDAC1 Q13547 2/20 0.31
HDAC2 Q92769 2/20 0.31
HDAC8 Q9BY41 2/20 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 SCHEMBL5013492 0.89 FFAR3 (0.32) FFAR3HDAC3HDAC1HDAC2HDAC8
Oxalic Acid SCHEMBL2420699 0.77 EGLN1 (0.37)
Oxalic Acid SCHEMBL28801176 0.72 LMNA (0.42) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL311383 0.72 OR51E2 (0.46)
Oxalic Acid SCHEMBL5016867 0.70
Oxalic Acid SCHEMBL15473617 0.69 CA4 (0.32)
Malonic Acid SCHEMBL15473528 0.69 CA4 (0.59)
Water SCHEMBL20787062 0.69 MAPK1 (0.31)
Oxalic Acid SCHEMBL5015133 0.67
Lithium Ion SCHEMBL7047575 0.67 LMNA (0.36) FFAR3HDAC3HDAC1HDAC2HDAC8

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
US-8652682-B2 Ionic compound, electrolytic solution, electrochemical device, and battery SONY CORPORATION (JP) 2014-02-18 US disclosed
US-20120058401-A1 ELECTROLYTIC SOLUTION FOR SECONDARY BATTERY, SECONDARY BATTERY, ELECTRIC POWER TOOL, ELECTRICAL VEHICLE, AND ELECTRIC POWER STORAGE SYSTEM SONY CORPORATION (JP) 2012-03-08 US disclosed