Oxalic Acid

Oxalic Acid

SCHEMBL1052305

CC[N+](CC)(CC)c1ccccc1.O=C([O-])C(=O)O

nearest known ligand 0.42

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 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.40
CES1 P23141 4/20 0.40
CHRM1 P11229 3/20 0.39
CHRM3 P20309 3/20 0.39
CHRM4 P08173 2/20 0.39
ALPL P05186 1/20 0.38
POLB P06746 1/20 0.38
ALPG P10696 1/20 0.38
CHRM2 P08172 2/20 0.36
LMNA P02545 1/20 0.36
AKR1B1 P15121 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
TSHR P16473 2/20 0.35
PTPN1 P18031 1/20 0.35
ERCC5 P28715 1/20 0.35
FEN1 P39748 1/20 0.35
SCN1A P35498 1/20 0.35
SCN2A Q99250 1/20 0.35
SCN3A Q9NY46 1/20 0.35

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 SCHEMBL1052302 0.94 CES2 (0.41) CES2CES1CHRM1CHRM3CHRM4
Bicarbonate SCHEMBL21957729 0.92 CES2 (0.43) CES2CES1CHRM1CHRM3CHRM4
Acetic Acid SCHEMBL7530111 0.90 CES2 (0.41) CES2CES1CHRM1CHRM3CHRM4
Oxalic Acid SCHEMBL1052304 0.90 CHRM1 (0.42) CES2CES1CHRM1CHRM3CHRM4
Propionic Acid SCHEMBL21957786 0.88 CES2 (0.44) CES2CES1CHRM1CHRM3CHRM4
Bicarbonate SCHEMBL21957730 0.87 CHRM1 (0.43) CES2CES1CHRM1CHRM3CHRM4
Malonic Acid SCHEMBL21957699 0.86 CES1 (0.39) CES2CES1CHRM1CHRM3CHRM4
Fumaric Acid SCHEMBL21957712 0.85 CES2 (0.38) CES2CES1CHRM1CHRM3CHRM4
Fumaric Acid SCHEMBL21957765 0.85 CES2 (0.38) CES2CES1CHRM1CHRM3CHRM4
Terephthalic Acid SCHEMBL21957720 0.85 CA2 (0.52) CES2CES1LMNACA2CA4

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-7867471-B2 Process for preparing advanced ceramic powders using onium dicarboxylates SACHEM, INC. (US) 2011-01-11 US disclosed
US-20090250850-A1 PROCESS FOR PREPARING ADVANCED CERAMIC POWDERS USING ONIUM DICARBOXYLATES SACHEM, INC. 2009-10-08 US disclosed