Oxalic Acid

Oxalic Acid

SCHEMBL19742819

COc1cccc(C(CCN(C)C)Oc2cccc3c2OCO3)c1.O=C(O)C(=O)O

nearest known ligand 0.45

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 13)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 3/20 0.41
UTS2R Q9UKP6 1/20 0.42
LMNA P02545 2/20 0.41
POLB P06746 1/20 0.41
HRH3 Q9Y5N1 2/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SLC6A9 P48067 1/20 0.40
SLC6A2 P23975 1/20 0.40
KCNH2 Q12809 1/20 0.40
AOC3 Q16853 1/20 0.39
HTR1A P08908 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
SCHEMBL31543761 0.94 AOC3 (0.44) UTS2RLMNAPOLBSLC6A4HRH3
SCHEMBL17880590 0.94 AOC3 (0.44) UTS2RLMNAPOLBSLC6A4HRH3
Oxalic Acid SCHEMBL31054153 0.89 SLC6A9 (0.44) SLC6A4HRH3KDM4EALDH1A1SLC6A9
Oxalic Acid SCHEMBL19742808 0.89 SLC6A9 (0.44) SLC6A4HRH3KDM4EALDH1A1SLC6A9
Oxalic Acid SCHEMBL19742742 0.89 KCNH2 (0.44) SLC6A4HRH3KDM4EALDH1A1SLC6A9
Oxalic Acid SCHEMBL19742813 0.88 KDM4E (0.41) UTS2RSLC6A4HRH3KDM4ESLC6A9
Oxalic Acid SCHEMBL19742736 0.88 AOC3 (0.38) SLC6A4HRH3KDM4EALDH1A1SLC6A9
Oxalic Acid SCHEMBL19742791 0.87 SLC6A4 (0.56) LMNAPOLBSLC6A4HRH3SLC6A2
Oxalic Acid SCHEMBL19742820 0.85 SLC6A9 (0.40) UTS2RSLC6A4HRH3SLC6A9SLC6A2
Oxalic Acid SCHEMBL19742815 0.84 SLC6A9 (0.43) UTS2RSLC6A4HRH3KDM4EALDH1A1

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-10093644-B2 3-[(Benzo[D][1,3]dioxolan-4-yl)-oxy]-3-arylpropylamine type compounds and applications thereof NHWA PHARMA. CORPORATION (CN) 2018-10-09 US disclosed
US-20170369466-A1 3-[(BENZO[D][1,3]DIOXOLAN-4-YL)-OXY]-3-ARYLPROPYLAMINE TYPE COMPOUNDS AND APPLICATIONS THEREOF NHWA PHARMA. CORPORATION (CN) 2017-12-28 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 (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-10093644-B2 3-[(Benzo[D][1,3]dioxolan-4-yl)-oxy]-3-arylpropylamine type compounds and applications thereof TPH1, MAOA, MAOB SLC6A4 7/4885UTS2R 3866/4885LMNA 1672/4885
US-20170369466-A1 3-[(BENZO[D][1,3]DIOXOLAN-4-YL)-OXY]-3-ARYLPROPYLAMINE TYPE COMPOUNDS AND APPLICATIONS THEREOF TPH1, MAOA, MAOB SLC6A4 7/4885UTS2R 3866/4885LMNA 1672/4885

“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.