Oxalic Acid

Oxalic Acid

SCHEMBL1835274

COC(C)NC(C)OC.O=C(O)C(=O)O

nearest known ligand 0.33

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 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 2/20 0.33
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.31
HIF1A Q16665 1/20 0.31
CA14 Q9ULX7 1/20 0.31
MEN1 O00255 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 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
Oxalic Acid SCHEMBL1835265 1.00 SMN1; SMN2 (0.33) SMN1; SMN2ALDH1A1SLC1A3SLC1A2SLC1A1
Bicarbonate SCHEMBL1831708 0.92 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1SLC1A3SLC1A2SLC1A1
Bicarbonate SCHEMBL1834590 0.92 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1SLC1A3SLC1A2SLC1A1
Pyruvate SCHEMBL1832070 0.90 ALDH1A1 (0.36) SMN1; SMN2ALDH1A1SLC1A3SLC1A2SLC1A1
Acetic Acid SCHEMBL1838385 0.89 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1SLC1A3SLC1A2SLC1A1
Lactic Acid SCHEMBL1833812 0.84 TP53 (0.55) SMN1; SMN2ALDH1A1SLC1A3SLC1A2SLC1A1
Bicarbonate SCHEMBL1831704 0.84 SMN1; SMN2 (0.31) SMN1; SMN2ALDH1A1SLC1A3SLC1A2SLC1A1
Cadaverine Tartrate SCHEMBL1830019 0.82 TSHR (0.48) SMN1; SMN2ALDH1A1SLC1A3SLC1A2SLC1A1
Fumaric Acid SCHEMBL1833868 0.82 HCAR2 (0.52) SMN1; SMN2ALDH1A1TP53
Succinic Acid SCHEMBL1833033 0.82 EGLN1 (0.43) ALDH1A1CYP1A2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 US claimed
US-9328220-B2 Liquids INNOVIA FILMS LIMITED (GB) 2016-05-03 US disclosed
US-8992798-B2 Liquids INNOVIA FILMS LIMITED (GB) 2015-03-31 US disclosed
US-8784686-B2 Liquids INNOVIA FILMS LIMITED (GB) 2014-07-22 US disclosed
US-20140187684-A1 LIQUIDS INNOVIA FILMS LIMITED (GB) 2014-07-03 US disclosed
US-20110257433-A1 LIQUIDS THE UNIVERSITY OF YORK (GB) 2011-10-20 US disclosed
EP-2322497-A1 Ionic liquids comprising nitrogen containing cations Innovia Films Limited (GB) 2011-05-18 EP disclosed
US-20080221361-A1 Ionic Liquids BIONIQS LIMITED (GB) 2008-09-11 US disclosed
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 US disclosed