Oxalic Acid

Oxalic Acid

SCHEMBL8916459

CCc1c(CCN2CCC(c3coc4ccc(Br)cc34)CC2)sc2c1CCN(C(C)=O)C2.O=C(O)C(=O)O

nearest known ligand 0.36

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 10)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 1/20 0.36
MAPT P10636 3/20 0.36
DRD2 P14416 12/20 0.36
HTR2A P28223 11/20 0.35
DRD3 P35462 11/20 0.35
CTSS P25774 1/20 0.35
MCHR1 Q99705 2/20 0.34
BAZ2B Q9UIF8 2/20 0.33
TP53 P04637 2/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL8916989 0.90 DRD2 (0.38) MAPTDRD2SLC6A4HTR2ADRD3
Hydrochloric Acid SCHEMBL8916342 0.89 DRD2 (0.38) MAPTDRD2SLC6A4HTR2ADRD3
Hydrochloric Acid SCHEMBL8917029 0.88 MCHR1 (0.41) MAPTDRD2SLC6A4HTR2ADRD3
SCHEMBL8919111 0.87 DRD2 (0.51) DRD2SLC6A4HTR2ADRD3
SCHEMBL8916977 0.86 CTSS (0.37) MAPTDRD2SLC6A4HTR2ADRD3
SCHEMBL8917881 0.85 CTSS (0.40) DRD2SLC6A4HTR2ADRD3CTSS
SCHEMBL8916768 0.85 CTSS (0.40) MAPTDRD2SLC6A4HTR2ADRD3
SCHEMBL8916164 0.84 CTSS (0.48) MAPTDRD2SLC6A4HTR2ADRD3
Hydrochloric Acid SCHEMBL8917167 0.84 CTSS (0.40) MAPTDRD2SLC6A4HTR2ADRD3
Hydrochloric Acid SCHEMBL8918060 0.84 CTSS (0.48) MAPTDRD2SLC6A4HTR2ADRD3

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-5691330-A ANTIPSYCHOTIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-11-25 US disclosed
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed