Oxalic Acid

Oxalic Acid

SCHEMBL7097823

O=C(O)C(=O)O.O=S(=O)(CCCCCCN1CCN(C(c2ccccc2)c2cccc(Cl)c2)CC1)NC1CC1

nearest known ligand 0.51

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 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 known ✓ P31645 1/20 0.44
▸ DRD3 P35462 11/20 0.51
▸ DRD2 P14416 10/20 0.51
▸ CACNA2D1 P54289 4/20 0.49
▸ CACNA1B Q00975 4/20 0.49
▸ CACNB1 Q02641 4/20 0.49
▸ CACNA1C Q13936 3/20 0.49
▸ CACNA1G O43497 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ ATM Q13315 1/20 0.44
▸ HRH1 P35367 2/20 0.44
▸ SLC6A2 P23975 1/20 0.44
▸ HRH2 P25021 1/20 0.44
▸ HTR2A P28223 1/20 0.44
▸ HTR2B P41595 1/20 0.44
▸ SLC6A3 Q01959 1/20 0.44
▸ TEK Q02763 1/20 0.44
▸ KCNH2 Q12809 1/20 0.44
▸ USP2 O75604 1/20 0.44

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
SCHEMBL7098300 0.96 DRD2 (0.49) DRD3DRD2CACNA2D1CACNA1BCACNB1
Hydrochloric Acid SCHEMBL7098258 0.95 DRD2 (0.49) DRD3DRD2CACNA2D1CACNA1BCACNB1
Bromide SCHEMBL7100449 0.95 DRD2 (0.49) DRD3DRD2CACNA2D1CACNA1BCACNB1
Hydrochloric Acid SCHEMBL7101513 0.95 DRD2 (0.49) DRD3DRD2CACNA2D1CACNA1BCACNB1
Fumaric Acid SCHEMBL7957768 0.94 DRD3 (0.49) DRD3DRD2CACNA2D1CACNA1BCACNB1
Fumaric Acid SCHEMBL7957738 0.94 DRD3 (0.49) DRD3DRD2CACNA2D1CACNA1BCACNB1
SCHEMBL7098340 0.94 DRD2 (0.45) DRD3DRD2CACNA2D1CACNA1BCACNB1
SCHEMBL7097625 0.88 DRD3 (0.57) DRD3DRD2HRH1SLC6A2HRH2
SCHEMBL7099285 0.88 DRD3 (0.57) DRD3DRD2HRH1SLC6A2HRH2
SCHEMBL7097660 0.88 DRD3 (0.57) DRD3DRD2HRH1SLC6A2HRH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1020443-B1 PROCESS FOR PRODUCING PIPERAZINESULFONAMIDE DERIVATIVES AND SALTS THEREOF AZWELL INC (JP) 2003-09-10 — — EP disclosed
US-6172228-B1 Process for producing piperazinesulfonamide derivatives and salts thereof AZWELL INC. (JP) 2001-01-09 — — US disclosed
EP-1020443-A1 PROCESS FOR PRODUCING PIPERAZINESULFONAMIDE DERIVATIVES AND SALTS THEREOF Azwell Inc. (JP) 2000-07-19 — — EP disclosed
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