Oxalic Acid

Oxalic Acid

SCHEMBL9795355

CC(C)(N)CNC(=O)CC(C)(C)CCO.O=C(O)C(=O)O

nearest known ligand 0.36

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 3)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.36
CPT2 P23786 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL9498415 0.95 FFAR1 (0.35) FFAR1CPT2TDP1
Oxalic Acid SCHEMBL9795316 0.75 FNTA (0.41) FFAR1TDP1
Hydrochloric Acid SCHEMBL23001647 0.74 KDM4E (0.32)
Oxalic Acid SCHEMBL9795337 0.73 FNTA (0.43) FFAR1TDP1
SCHEMBL9501589 0.72 MEN1 (0.32)
Oxalic Acid SCHEMBL9795335 0.72 ALDH1A1 (0.34)
Oxalic Acid SCHEMBL9795276 0.69 ALDH1A1 (0.32)
SCHEMBL9500008 0.68 RECQL (0.42) FFAR1TDP1
Oxalic Acid SCHEMBL9795476 0.68 RIPK1 (0.32)
SCHEMBL5940256 0.68 MEN1 (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5037849-A For treatment of heart and circulatory diseases BOEHRINGER MANNHEIM GMBH (DE) 1991-08-06 US disclosed