Oxalic Acid

Oxalic Acid

SCHEMBL31679080

COc1cccc(-c2nc(C)c(C)[nH]2)c1.O=C(O)C(=O)O

nearest known ligand 0.72

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
PIN1 Q13526 2/20 0.72
SLC9A1 P19634 1/20 0.56
PARP1 P09874 1/20 0.53
HCRTR1 O43613 1/20 0.52
GRK6 P43250 1/20 0.49
AURKA O14965 1/20 0.49
SMPD3 Q9NY59 1/20 0.49
NR1I2 O75469 1/20 0.48
CYP1A2 P05177 1/20 0.48
VDR P11473 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2B6 P20813 1/20 0.48
AHR P35869 1/20 0.48
NR1I3 Q14994 1/20 0.48
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
DHODH Q02127 1/20 0.47
NPC1 O15118 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47

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
SCHEMBL20425475 0.92 PIN1 (0.66) PIN1SLC9A1PARP1HCRTR1AURKA
Oxalic Acid SCHEMBL31679103 0.83 SMPD3 (0.50) PIN1PARP1SMPD3CYP1A2KDM4E
Oxalic Acid SCHEMBL31679108 0.83 PIN1 (0.63) PIN1SLC9A1PARP1HCRTR1GRK6
SCHEMBL8963628 0.81 PIN1 (0.81) PIN1SLC9A1PARP1HCRTR1AURKA
Oxalic Acid SCHEMBL31679101 0.81 PIN1 (0.71) PIN1SLC9A1PARP1KDM4EALDH1A1
SCHEMBL8963666 0.77 PIN1 (0.73) PIN1SLC9A1PARP1HCRTR1GRK6
SCHEMBL8964024 0.77 PIN1 (0.62) PIN1SLC9A1PARP1HCRTR1AURKA
SCHEMBL3621960 0.74 VDR (0.63) PIN1VDRKDM4EALDH1A1NPC1
Oxalic Acid SCHEMBL31679093 0.74 PIN1 (0.52) PIN1PARP1GRK6AURKASMPD3
SCHEMBL25754934 0.74 PIN1 (0.63) PIN1SLC9A1PARP1GRK6AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12403128-B2 Compositions and methods for blocking sodium channels Univerity of Virginia Patent Foundation (US) 2025-09-02 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-12403128-B2 Compositions and methods for blocking sodium channels SCN3A, SCN1B, SCN2B PIN1 1981/4885SLC9A1 51/4885PARP1 4869/4885

“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.