Oxalic Acid

Oxalic Acid

SCHEMBL7329503

Fc1ccc(C(c2ccc(F)cc2)C2CCNCC2)cc1.O=C(O)C(=O)O

nearest known ligand 0.51

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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 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 2/20 0.41
OPRD1 P41143 1/20 0.51
SLC6A2 P23975 2/20 0.41
SLC6A3 Q01959 2/20 0.41

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
SCHEMBL7319671 0.90 SLC6A2 (0.45) OPRD1SLC6A2SLC6A4SLC6A3
Oxalic Acid SCHEMBL7441568 0.89 OPRD1 (0.44) OPRD1SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL9768345 0.88 SLC6A2 (0.46) OPRD1SLC6A2SLC6A4SLC6A3
Fumaric Acid SCHEMBL7442255 0.88 SLC6A2 (0.52) OPRD1SLC6A2SLC6A4SLC6A3
Fumaric Acid SCHEMBL7442269 0.88 SLC6A2 (0.52) OPRD1SLC6A2SLC6A4SLC6A3
Formic Acid SCHEMBL21381648 0.87 OPRD1 (0.45) OPRD1SLC6A2SLC6A4SLC6A3
SCHEMBL7325604 0.87 OPRD1 (0.53) OPRD1SLC6A2SLC6A4SLC6A3
SCHEMBL21382056 0.87 OPRD1 (0.53) OPRD1SLC6A2SLC6A4SLC6A3
SCHEMBL30149800 0.87 OPRD1 (0.53) OPRD1SLC6A2SLC6A4SLC6A3
SCHEMBL21382026 0.87 OPRD1 (0.53) OPRD1SLC6A2SLC6A4SLC6A3

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
US-4032642-A SEDATIVES, TRANQUILIZERS A. H. ROBINS COMPANY, INCORPORATED (US) 1977-06-28 US disclosed
US-3956296-A ANTIINFLAMMATORY, SEDATIVES, TRANQUILIZERS A. H. ROBINS COMPANY, INCORPORATED (US) 1976-05-11 US disclosed