Oxalic Acid

Oxalic Acid

SCHEMBL6140551

CCCCc1oc2ccc(C(=O)N(C)C)cc2c1C(=O)c1ccc(/C=C\CN(CCCC)CCCC)cc1.O=C(O)C(=O)O

nearest known ligand 0.50

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 0.47
OPRM1 known ✓ P35372 1/20 0.47
ESR1 P03372 1/20 0.47
PGR P06401 1/20 0.47
CHRM2 P08172 1/20 0.47
HTR1A P08908 1/20 0.47
ADRA2A P08913 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
CHRM1 P11229 1/20 0.47
DRD1 P21728 1/20 0.47
TBXA2R P21731 1/20 0.47
SLC6A2 P23975 1/20 0.47
PDE4A P27815 1/20 0.47
ADRA1A P35348 1/20 0.47
DRD3 P35462 1/20 0.47
SLC6A3 Q01959 1/20 0.47
KCNH2 Q12809 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
ABCB11 O95342 1/20 0.46
KCNA5 P22460 1/20 0.46

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
Oxalic Acid SCHEMBL6140555 1.00 ESR1 (0.47) ESR1PGRCHRM2HTR1AADRA2A
SCHEMBL6593554 0.97 ESR1 (0.49) ESR1PGRCHRM2HTR1AADRA2A
SCHEMBL6593557 0.97 ESR1 (0.49) ESR1PGRCHRM2HTR1AADRA2A
Oxalic Acid SCHEMBL6140572 0.92 ESR1 (0.49) ESR1PGRCHRM2HTR1AADRA2A
Oxalic Acid SCHEMBL6140582 0.92 ESR1 (0.49) ESR1PGRCHRM2HTR1AADRA2A
Oxalic Acid SCHEMBL6140507 0.90 ESR1 (0.47) ESR1PGRCHRM2HTR1AADRA2A
Oxalic Acid SCHEMBL6140513 0.90 ESR1 (0.47) ESR1PGRCHRM2HTR1AADRA2A
SCHEMBL6141657 0.90 ESR1 (0.50) ESR1PGRCHRM2HTR1AADRA2A
SCHEMBL6141658 0.90 ESR1 (0.50) ESR1PGRCHRM2HTR1AADRA2A
SCHEMBL6594789 0.90 ESR1 (0.50) ESR1PGRCHRM2HTR1AADRA2A

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-6946483-B2 Aminoalkenylbenzoyl-benzofuran or benzothiophene, method for preparing same and compositions containing same SANOFI-AVENTIS (FR) 2005-09-20 US disclosed
US-20030187060-A1 Aminoalkenylbenzoyl-benzofuran or benzothiophene, method for preparing same and compositions containing same SANOFI (FR) 2003-10-02 US 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 (1 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-20030187060-A1 Aminoalkenylbenzoyl-benzofuran or benzothiophene, method for preparing same and compositions containing same ABAT, TNNT2, BCAT2 SLC6A4 1987/4885OPRM1 2970/4885ESR1 3751/4885

“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.