Oxalic Acid

Oxalic Acid

SCHEMBL8106050

CCc1cc([C@H]2CCCN2)on1.O=C(O)C(=O)O

nearest known ligand 0.84

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 7)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.39
CHRNA4 P43681 1/20 0.39
CHRM2 P08172 5/20 0.39
CHRM5 P08912 5/20 0.39
CHRM3 P20309 5/20 0.39
CHRM4 P08173 4/20 0.39
CHRM1 P11229 4/20 0.39

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 SCHEMBL8119281 1.00 CHRNB2 (0.39) CHRNB2CHRNA4CHRM2CHRM5CHRM3
SCHEMBL8107540 0.92 CHRM2 (0.45) CHRNB2CHRNA4CHRM2CHRM5CHRM3
SCHEMBL8113248 0.92 CHRM2 (0.45) CHRNB2CHRNA4CHRM2CHRM5CHRM3
Oxalic Acid SCHEMBL8104972 0.83 CHRNB2 (0.44) CHRNB2CHRNA4CHRM2CHRM5CHRM3
Oxalic Acid SCHEMBL8114514 0.83 CHRNB2 (0.44) CHRNB2CHRNA4CHRM2CHRM5CHRM3
SCHEMBL8121403 0.80 CHRM2 (0.43) CHRNB2CHRNA4CHRM2CHRM5CHRM3
SCHEMBL8104421 0.78 CHRM2 (0.41) CHRNB2CHRNA4CHRM2CHRM5CHRM3
SCHEMBL8105457 0.74 ALDH1A1 (0.47) CHRNB2CHRNA4CHRM2CHRM5CHRM3
Trifluoroacetic Acid SCHEMBL953331 0.74 CHRM2 (0.40) CHRNB2CHRNA4CHRM2CHRM5CHRM3
SCHEMBL8114272 0.73 CHRM2 (0.51) CHRNB2CHRNA4CHRM2CHRM5CHRM3

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
EP-0588917-B1 ISOXAZOLE AND ISOTHIAZOLE COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION ABBOTT LAB (US) 2000-11-08 EP disclosed
US-5409946-A Antiepileptic agent ABBOTT LABORATORIES (US) 1995-04-25 US disclosed