Oxalic Acid

Oxalic Acid

SCHEMBL5657249

Cn1c(CCCCc2ccccc2)ccc1CC[C@@](C)(N)CO.O=C(O)C(=O)O

nearest known ligand 0.41

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
S1PR1 P21453 2/20 0.41
S1PR3 Q99500 2/20 0.41
S1PR5 Q9H228 2/20 0.41
GRM2 Q14416 2/20 0.38
GRM3 Q14832 2/20 0.38
POLB P06746 1/20 0.38
LTB4R Q15722 3/20 0.37
MAPT P10636 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
FAAH O00519 3/20 0.36
CES1 P23141 3/20 0.36
ALOX5 P09917 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.36
HDAC3 O15379 1/20 0.36
MAPK1 P28482 1/20 0.36
ADRA1A P35348 1/20 0.36
HDAC4 P56524 1/20 0.36

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 SCHEMBL5658166 0.99 S1PR1 (0.41) S1PR1S1PR3S1PR5GRM2GRM3
SCHEMBL387206 0.94 TNNC1 (0.40) S1PR1S1PR3S1PR5LTB4RMAPT
SCHEMBL385473 0.94 TNNC1 (0.40) S1PR1S1PR3S1PR5LTB4RMAPT
Oxalic Acid SCHEMBL3195958 0.88 S1PR1 (0.38) S1PR1S1PR3S1PR5GRM2GRM3
SCHEMBL385571 0.85 S1PR1 (0.56) S1PR1S1PR3S1PR5MAPTRXFP1
SCHEMBL384958 0.85 S1PR1 (0.56) S1PR1S1PR3S1PR5MAPTRXFP1
Hydrochloric Acid SCHEMBL387256 0.84 S1PR1 (0.56) S1PR1S1PR3S1PR5MAPTRXFP1
Hydrochloric Acid SCHEMBL386151 0.84 S1PR1 (0.56) S1PR1S1PR3S1PR5MAPTRXFP1
Oxalic Acid SCHEMBL386933 0.84 S1PR1 (0.38) S1PR1S1PR3S1PR5POLBALDH1A1
SCHEMBL383826 0.83 S1PR1 (0.60) S1PR1S1PR3S1PR5POLBMAPT

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-7199150-B2 Amino alcohol compounds SANKYO COMPANY, LIMITED (JP) 2007-04-03 US disclosed
US-20050043386-A1 Amino alcohol derivatives or phosphonic acid derivatives and pharmaceutical compositions containing these SANKYO COMPANY, LIMITED (JP) 2005-02-24 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-20050043386-A1 Amino alcohol derivatives or phosphonic acid derivatives and pharmaceutical compositions containing these PHOSPHO1, CD4, FCGRT S1PR1 257/4885S1PR3 414/4885S1PR5 503/4885

“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.