Oxalic Acid

Oxalic Acid

SCHEMBL7953188

O=C(O)C(=O)O.c1csc(CCCSc2nsnc2[C@H]2CN3CCC[C@H]2C3)c1

nearest known ligand 0.71

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 2)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 2/20 0.54
CHRM2 P08172 2/20 0.54

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 SCHEMBL7810636 1.00 CHRM1 (0.54) CHRM1CHRM2
Oxalic Acid SCHEMBL7821928 0.95 CHRM2 (0.52) CHRM1CHRM2
SCHEMBL7810793 0.95 CHRM1 (0.56) CHRM1CHRM2
SCHEMBL7989374 0.95 CHRM1 (0.56) CHRM1CHRM2
SCHEMBL7818869 0.90 CHRM2 (0.54) CHRM1CHRM2
Oxalic Acid SCHEMBL7811971 0.88 CHRM2 (0.61) CHRM1CHRM2
Fumaric Acid SCHEMBL7820760 0.85 CHRM2 (0.44) CHRM1CHRM2
Fumaric Acid SCHEMBL7820759 0.85 CHRM2 (0.44) CHRM1CHRM2
SCHEMBL7818023 0.85 CHRM2 (0.48) CHRM2
SCHEMBL7810907 0.83 CHRM2 (0.65) CHRM1CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6281233-B1 AZABICYCLIC RING-SUBSTITUTED THIA- OR OXADIAZOLES NOVO NORDISK A/S (DK) 2001-08-28 US disclosed
US-6281232-B1 AZABICYCLIC RING-SUBSTITUTED THIA- OR OXADIAZOLES NOVO NORDISK A/S (DK) 2001-08-28 US disclosed
US-6271229-B1 ADMINISTERING A 1,2,5-OXADIAZOLE COMPOUND OR 1,2,5-THIADIAZOLE COMPOUND NOVO NORDISK A/S (DK) 2001-08-07 US disclosed
US-6265419-B1 IRRITABLE BOWEL DISORDER NOVO NORDISK A/S (DK) 2001-07-24 US disclosed
US-5710151-A ADMINISTERING A THIADIAZOLE OR AN OXADIAZOLE DERIVATIVE TO A SUBJECT MUHLHAUSER MARK A (US) 1998-01-20 US disclosed
US-5612351-A AZABICYCLIC DERIVATIVES OF 1,2,3-OXA(OR THIA)DIAZOLE NOVO NORDISK A/S (DK) 1997-03-18 US disclosed
WO-1996014316-A1 A METHOD OF TREATING URINARY BLADDER DYSFUNCTIONS NOVO NORDISK A/S (DK) 1996-05-17 WO disclosed