Oxalic Acid

Oxalic Acid

SCHEMBL28313461

CCC(=O)OCC(O)CO.O=C(O)C(=O)O

nearest known ligand 0.56

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 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.56
DUSP3 P51452 1/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
LMNA P02545 1/20 0.56
DGKA P23743 1/20 0.47
FAAH O00519 4/20 0.45
CNR2 P34972 3/20 0.37
USP2 O75604 1/20 0.36
NAAA Q02083 1/20 0.35
LPAR6 P43657 1/20 0.35
LPAR1 Q92633 1/20 0.35
LPAR4 Q99677 1/20 0.35
LPAR5 Q9H1C0 1/20 0.35
LPAR2 Q9HBW0 1/20 0.35
LPAR3 Q9UBY5 1/20 0.35
ENPP2 Q13822 1/20 0.35
OR51E2 Q9H255 1/20 0.34

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
SCHEMBL12572610 0.94 KDM4E (0.61) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL1408649 0.94 KDM4E (0.61) KDM4EDUSP3MEN1KMT2ALMNA
Propionic Acid SCHEMBL76956 0.92 KDM4E (0.56) KDM4EDUSP3MEN1KMT2ALMNA
Propionic Acid SCHEMBL1641539 0.92 KDM4E (0.56) KDM4EDUSP3MEN1KMT2ALMNA
Propionic Acid SCHEMBL9957094 0.92 KDM4E (0.56) KDM4EDUSP3MEN1KMT2ALMNA
Methacrylic Acid SCHEMBL2830657 0.89 KDM4E (0.50) KDM4EDUSP3MEN1KMT2ALMNA
Acrylic Acid SCHEMBL28006437 0.85 LMNA (0.50) KDM4EDUSP3MEN1KMT2ALMNA
Propionic Acid SCHEMBL28172450 0.84 MEN1 (0.49) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL9463770 0.83 KDM4E (0.47) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL28988208 0.80 KDM4E (0.53) KDM4EDUSP3MEN1KMT2ALMNA

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
CN-110150760-A A kind of aerosol generation system 钟术光 2019-08-23 CN disclosed
CN-110025057-A A kind of method and device improving electronic cigarette safety 钟术光 2019-07-19 CN disclosed