Oxalic Acid

Oxalic Acid

SCHEMBL7607255

CCC(N)N.O=C(O)C(=O)O

nearest known ligand 0.44

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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
SLC1A3 P43003 2/20 0.44
SLC1A2 P43004 2/20 0.44
SLC1A1 P43005 2/20 0.44
ALOX15 P16050 1/20 0.40
GRIK1 P39086 6/20 0.39
GRIA4 P48058 1/20 0.39
GRIK3 Q13003 1/20 0.39
GRIK5 Q16478 1/20 0.39
LAP3 P28838 1/20 0.39
FFAR3 O14843 1/20 0.39
GRIK2 Q13002 4/20 0.38
GABRP O00591 2/20 0.38
GABRD O14764 2/20 0.38
GABRA1 P14867 2/20 0.38
GABRB1 P18505 2/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
GABRA5 P31644 2/20 0.38
GABRA3 P34903 2/20 0.38
GABRA2 P47869 2/20 0.38

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
Acetic Acid SCHEMBL10874504 0.87 FFAR3 (0.47) SLC1A3SLC1A2SLC1A1ALOX15GRIK1
Carbamic Acid SCHEMBL9280663 0.87
Acetic Acid SCHEMBL19350438 0.87 FFAR3 (0.47) SLC1A3SLC1A2SLC1A1ALOX15GRIK1
Acetic Acid SCHEMBL242246 0.87 FFAR3 (0.47) SLC1A3SLC1A2SLC1A1ALOX15GRIK1
Acetic Acid SCHEMBL6280777 0.87
Propionic Acid SCHEMBL30448445 0.84 FFAR3 (0.62) SLC1A3SLC1A2SLC1A1GRIK1GRIA4
Acetic Acid SCHEMBL5351332 0.84 FFAR3 (0.44) SLC1A3SLC1A2SLC1A1GRIK1GRIA4
Acetic Acid SCHEMBL9737099 0.84 FFAR3 (0.44) SLC1A3SLC1A2SLC1A1GRIK1GRIA4
Acetic Acid SCHEMBL9644947 0.84 FFAR3 (0.44) SLC1A3SLC1A2SLC1A1GRIK1GRIA4
Propionic Acid SCHEMBL28047135 0.84 FFAR3 (0.62) SLC1A3SLC1A2SLC1A1GRIK1GRIA4

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-1263718-A1 NOVEL USE OF PHENYLHETEROALKYLAMINE DERIVATIVES AstraZeneca AB (SE) 2002-12-11 EP disclosed
WO-2001062721-A1 NOVEL USE OF PHENYLHETEROALKYLAMINE DERIVATIVES ASTRAZENECA AB (SE) 2001-08-30 WO disclosed