Oxalic Acid

Oxalic Acid

SCHEMBL7194124

O=C([O-])C(=O)[O-].O=C([O-])C(=O)[O-].O=C([O-])C(=O)[O-].O=C([O-])C(=O)[O-].O=C([O-])C(=O)[O-].[NH4+].[NH4+].[Ti+4].[Ti+4]

nearest known ligand 0.70

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 9)

geneUniProtsupporting neighboursconfidence
CA4 P22748 5/20 0.70
FAHD1 Q6P587 1/20 0.70
MEN1 O00255 1/20 0.43
LDHA P00338 1/20 0.43
BLM P54132 1/20 0.43
KMT2A Q03164 1/20 0.43
CA1 P00915 2/20 0.42
LMNA P02545 2/20 0.33
CASP1 P29466 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 SCHEMBL3219989 1.00 CA4 (0.70) CA4FAHD1MEN1LDHABLM
Oxalic Acid SCHEMBL11383539 0.95 CA4 (0.64) CA4FAHD1MEN1LDHABLM
Oxalic Acid SCHEMBL79869 0.94 CA4 (0.78) CA4FAHD1MEN1LDHABLM
Oxalic Acid SCHEMBL93229 0.94 CA4 (0.78) CA4FAHD1MEN1LDHABLM
Oxalic Acid SCHEMBL31182112 0.94
Oxalic Acid SCHEMBL21753837 0.94 CA4 (0.78) CA4FAHD1MEN1LDHABLM
Oxalic Acid SCHEMBL8340490 0.91 CA4 (0.58) CA4FAHD1MEN1LDHABLM
Oxalic Acid SCHEMBL2485726 0.89 CA4 (0.70) CA4FAHD1MEN1LDHABLM
Oxalic Acid SCHEMBL8075066 0.89 CA4 (0.70) CA4FAHD1MEN1LDHABLM
Oxalic Acid SCHEMBL2332088 0.89 CA4 (0.70) CA4FAHD1MEN1LDHABLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6585863-B2 By zeolite and/or mesoporous material hosted photocatalysts; air, water pollution control PROCTER & GAMBLE COMPANY 2003-07-01 US disclosed
US-20020108846-A1 Photocatalytic degradation of organic compounds THE PROCTER & GAMBLE COMPANY 2002-08-15 US disclosed
WO-2002012132-A2 PHOTOCATALYTIC DEGRADATION OF ORGANIC COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2002-02-14 WO disclosed