Oxalic Acid

Oxalic Acid

SCHEMBL7224209

COc1ccc(C(=O)c2ccc3ccn(C4CCN(CCc5ccc(F)cc5)CC4)c3c2)cn1.O=C(O)C(=O)O

nearest known ligand 0.44

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 0.39
OPRM1 known ✓ P35372 1/20 0.38
HTR1A P08908 2/20 0.44
HTR1D P28221 2/20 0.44
HTR1B P28222 2/20 0.44
HTR1F P30939 1/20 0.44
HTR2A P28223 7/20 0.41
HTR2C P28335 3/20 0.41
HTR7 P34969 3/20 0.41
HTR6 P50406 2/20 0.41
GRM2 Q14416 3/20 0.39
HRH1 P35367 2/20 0.39
ADRA2A P08913 1/20 0.39
DRD2 P14416 1/20 0.39
ADRA2C P18825 1/20 0.39
DRD1 P21728 1/20 0.39
DRD4 P21917 1/20 0.39
DRD5 P21918 1/20 0.39
HRH2 P25021 1/20 0.39
ADRA1A P35348 1/20 0.39

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
SCHEMBL5871629 0.98 HTR1A (0.46) HTR1AHTR1DHTR1BHTR1FHTR2A
Oxalic Acid SCHEMBL5871722 0.86 HTR2A (0.40) HTR1AHTR1DHTR1BHTR1FHTR2A
SCHEMBL5871726 0.82 HTR1D (0.40) HTR1AHTR1DHTR1BHTR1FHTR2A
SCHEMBL5872070 0.82 HTR2A (0.43) HTR1AHTR1DHTR1BHTR1FHTR2A
SCHEMBL7224211 0.81 PIK3CG (0.42) HTR1AHTR1DHTR1BHTR2AHTR2C
SCHEMBL5871465 0.79 HTR2A (0.53) HTR1AHTR1DHTR1BHTR1FHTR2A
SCHEMBL5871347 0.77 SLC6A4 (0.55) HTR1AHTR2AHTR2CHTR7HTR6
Oxalic Acid SCHEMBL5871700 0.77 HTR2A (0.49) HTR1AHTR1DHTR1BHTR1FHTR2A
Oxalic Acid SCHEMBL5871218 0.76 HTR1A (0.46) HTR1AHTR1DHTR1BHTR1FHTR2A
SCHEMBL5871172 0.75 HTR1A (0.52) HTR1AHTR2AHTR2CHTR7HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6579881-B2 Indoles EISAI CO., LTD. (JP) 2003-06-17 US disclosed
US-6448243-B1 SEROTONIN ANTAGONIST FOR TREATING, AMELIORATING AND PREVENTING SPASTIC PARALYSIS OR CENTRAL MUSCLE RELAXANTS FOR AMELIORATING MYOTONIA EISAI CO., LTD. (JP) 2002-09-10 US disclosed
US-20020086999-A1 Certain quinoline derivatives EISAI CO., LTD. 2002-07-04 US disclosed
US-20020019531-A1 Indoles EISAI CO., LTD. 2002-02-14 US disclosed
EP-0976732-A1 1,4-SUBSTITUTED CYCLIC AMINE DERIVATIVES Eisai Co., Ltd. (JP) 2000-02-02 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020019531-A1 Indoles INMT, MUSK, MB SLC6A4 25/4885OPRM1 471/4885HTR1A 17/4885
US-20020086999-A1 Certain quinoline derivatives CHRM1, CHRNA5, CHRNA4 SLC6A4 114/4885OPRM1 340/4885HTR1A 14/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.