Oxalic Acid

Oxalic Acid

SCHEMBL8480955

O=C(O)C(=O)O.OC(CCc1cccnc1)COc1cccc(-c2ccccc2)c1

nearest known ligand 0.53

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 10)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.53
GPR132 Q9UNW8 12/20 0.50
PTAFR P25105 2/20 0.48
PRMT5 O14744 2/20 0.48
WDR77 Q9BQA1 2/20 0.48
CMKLR2 P46091 1/20 0.45
CMKLR1 Q99788 1/20 0.45
MRGPRX4 Q96LA9 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL8480926 0.96 EPHX1 (0.51) EPHX1GPR132PTAFRPRMT5WDR77
SCHEMBL8477406 0.89 GPR132 (0.50) EPHX1GPR132PTAFRPRMT5WDR77
SCHEMBL8553957 0.89 GPR132 (0.50) EPHX1GPR132PTAFRPRMT5WDR77
Oxalic Acid SCHEMBL8476733 0.87 MEN1 (0.46) EPHX1GPR132PTAFRMEN1KMT2A
Oxalic Acid SCHEMBL8483076 0.87 MEN1 (0.46) EPHX1GPR132PTAFRMEN1KMT2A
Oxalic Acid SCHEMBL8476688 0.85 MMP12 (0.55) EPHX1GPR132PTAFRMEN1KMT2A
SCHEMBL8481421 0.85 MEN1 (0.52) GPR132PTAFRMEN1KMT2A
SCHEMBL8109540 0.85 MEN1 (0.52) GPR132PTAFRMEN1KMT2A
SCHEMBL8479732 0.85 MEN1 (0.52) GPR132PTAFRMEN1KMT2A
SCHEMBL6949036 0.85 MEN1 (0.53) GPR132MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5977105-A Compounds ASTRA PHARMAEUTICALS LTD. (GB) 1999-11-02 US disclosed
EP-0865431-A2 COMPOUNDS Astra Pharmaceuticals Limited (GB) 1998-09-23 EP disclosed
WO-1997020815-A1 COMPOUNDS ASTRA PHARMACEUTICALS LTD. (GB) 1997-06-12 WO disclosed