Oxalic Acid

Oxalic Acid

SCHEMBL9793607

CNS(=O)(=O)CCc1ccc2[nH]cc(C3=CCN(C)CC3)c2c1.O=C(O)C(=O)O

nearest known ligand 0.63

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 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 4/20 0.54
HTR1A P08908 1/20 0.55
HTR1D P28221 1/20 0.55
HTR1B P28222 1/20 0.55

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
SCHEMBL1275552 0.95 SLC6A4 (0.59) HTR1AHTR1DHTR1BSLC6A4
Hydrochloric Acid SCHEMBL9764443 0.86 SLC6A4 (0.61) SLC6A4
SCHEMBL4541937 0.84 SLC6A4 (0.61) SLC6A4
SCHEMBL9772971 0.80 SLC6A4 (0.59) SLC6A4
Hydrochloric Acid SCHEMBL9772910 0.80 SLC6A4 (0.59) SLC6A4
SCHEMBL14207477 0.79 SLC6A4 (0.53) HTR1ASLC6A4
SCHEMBL12015468 0.78 HTR6 (0.45) HTR1AHTR1DHTR1B
SCHEMBL15292058 0.76 SLC6A4 (0.60) SLC6A4
SCHEMBL14207392 0.76 SLC6A4 (0.56) SLC6A4
SCHEMBL7809897 0.76 SLC6A4 (0.69) SLC6A4

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-4997841-A Indole derivatives GLAXO GROUP LIMITED (GB) 1991-03-05 US disclosed
EP-0303507-A2 Indole derivatives GLAXO GROUP LIMITED (GB) 1989-02-15 EP disclosed