Oxalic Acid

Oxalic Acid

SCHEMBL7064622

O.O.O.O=C(O)C(=O)O.[Cr]

nearest known ligand 0.44

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
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
LDHA P00338 2/20 0.42
LDHB P07195 1/20 0.42
TSHR P16473 3/20 0.39
TP53 P04637 2/20 0.39
ALDH1A1 P00352 1/20 0.39
ACHE P22303 1/20 0.36
FFAR3 O14843 1/20 0.36
LCK P06239 1/20 0.36
FYN P06241 1/20 0.36
KDM5B Q9UGL1 1/20 0.36
OR51E2 Q9H255 1/20 0.33
EGLN1 Q9GZT9 2/20 0.31
SRR Q9GZT4 1/20 0.31
LMNA P02545 1/20 0.31
ALKBH5 Q6P6C2 1/20 0.31
SUCNR1 Q9BXA5 1/20 0.31
EGLN3 Q9H6Z9 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 SCHEMBL785518 1.00 CA1 (0.44) CA1CA2CA9LDHALDHB
Oxalic Acid SCHEMBL786271 1.00
Oxalic Acid SCHEMBL7201736 0.94 CA1 (0.40) CA1CA2CA9LDHALDHB
Oxalic Acid SCHEMBL1396101 0.94
Oxalic Acid SCHEMBL20338159 0.94 CA1 (0.50) CA1CA2CA9LDHALDHB
Oxalic Acid SCHEMBL376974 0.94
Oxalic Acid SCHEMBL1402346 0.94 CA1 (0.50) CA1CA2CA9LDHALDHB
Oxalic Acid SCHEMBL6696050 0.94 CA1 (0.50) CA1CA2CA9LDHALDHB
Oxalic Acid SCHEMBL2566908 0.94 CA1 (0.50) CA1CA2CA9LDHALDHB
Oxalic Acid SCHEMBL3399924 0.94 CA1 (0.50) CA1CA2CA9LDHALDHB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1341748-A2 STABILIZED CYCLOBUTANONE COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 2003-09-10 EP disclosed
EP-1180509-B1 Process for the recovery and purification of cyclobutanone EASTMAN CHEM CO (US) 2003-06-04 EP disclosed
US-6444096-B1 FROM A CRUDE PRODUCT MIXTURE OBTAINED FROM AN OXIDATION PRODUCT MIXTURE RESULTING FROM THE OXIDATION OF CYCLOBUTANOL TO CYCLOBUTANONE IN THE PRESENCE OF WATER EASTMAN CHEMICAL COMPANY 2002-09-03 US disclosed
WO-2002048083-A2 STABILIZED CYCLOBUTANONE COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 2002-06-20 WO disclosed
EP-1180509-A1 Process for the recovery and purification of cyclobutanone EASTMAN CHEMICAL COMPANY (US) 2002-02-20 EP disclosed
US-6248927-B1 PHENOLIC STABILIZER EASTMAN CHEMICAL COMPANY 2001-06-19 US disclosed