Oxalic Acid

Oxalic Acid

SCHEMBL8917846

CC(=O)N1CCc2cc(CCCN3CCC(c4noc5cc(F)ccc45)CC3)sc2C1.O=C(O)C(=O)O

nearest known ligand 0.56

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 2/20 0.52
OPRM1 known ✓ P35372 1/20 0.52
DRD2 P14416 6/20 0.54
HTR1A P08908 5/20 0.54
HTR2A P28223 5/20 0.54
ADRA2A P08913 2/20 0.54
HTR2C P28335 2/20 0.54
ADRA1A P35348 2/20 0.54
HRH1 P35367 2/20 0.54
HTR6 P50406 2/20 0.54
KCNH2 Q12809 2/20 0.54
ADRA1D P25100 1/20 0.54
ADRA1B P35368 1/20 0.54
ABCB11 O95342 1/20 0.52
CHRM2 P08172 1/20 0.52
CHRM1 P11229 1/20 0.52
ADRA2B P18089 1/20 0.52
ADRA2C P18825 1/20 0.52
DRD1 P21728 1/20 0.52
DRD4 P21917 1/20 0.52

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
SCHEMBL8917299 0.93 DRD2 (0.56) DRD2HTR1AHTR2AADRA2AHTR2C
SCHEMBL8917984 0.89 HTR2A (0.55) DRD2HTR1AHTR2AADRA2AHTR2C
Hydrochloric Acid SCHEMBL8991836 0.88 HTR2A (0.55) DRD2HTR1AHTR2AADRA2AHTR2C
SCHEMBL9408142 0.87 DRD2 (0.56) DRD2HTR2AKCNH2SLC6A4ACHE
SCHEMBL8918296 0.87 MCHR1 (0.62) DRD2HTR1AHTR2AADRA2AHTR2C
Hydrochloric Acid SCHEMBL8917151 0.84 MCHR1 (0.54) DRD2HTR1AHTR2AADRA2AHTR2C
SCHEMBL8917275 0.83 DRD2 (0.51) DRD2HTR1AHTR2AADRA2AHTR2C
SCHEMBL8916687 0.83 DRD2 (0.54) DRD2HTR1AHTR2AADRA2AHTR2C
Hydrochloric Acid SCHEMBL8991890 0.82 MCHR1 (0.56) DRD2HTR1AHTR2AADRA2AHTR2C
SCHEMBL8916147 0.81 DRD2 (0.54) DRD2HTR1AHTR2AADRA2AHTR2C

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