Oxalic Acid

Oxalic Acid

SCHEMBL7990786

FC(F)(F)c1cccc(OCCCc2c[nH]cn2)c1.O=C(O)C(=O)O

nearest known ligand 0.54

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 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.52
ALDH1A1 P00352 3/20 0.52
GAA P10253 2/20 0.52
MCL1 Q07820 2/20 0.52
KMT2A Q03164 2/20 0.51
LMNA P02545 2/20 0.51
HTT P42858 2/20 0.51
MRGPRX4 Q96LA9 1/20 0.45
USP2 O75604 1/20 0.44
FAAH O00519 1/20 0.43
PTGES O14684 1/20 0.43
ALOX5 P09917 1/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
NR4A2 P43354 1/20 0.42
L3MBTL1 Q9Y468 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
SCHEMBL4385045 0.93 L3MBTL1 (0.47) KDM4EALDH1A1GAAMCL1KMT2A
SCHEMBL4385050 0.89 LMNA (0.48) KDM4EALDH1A1GAAMCL1KMT2A
Oxalic Acid SCHEMBL4394339 0.83 CNR1 (0.42) KDM4EALDH1A1KMT2A
Oxalic Acid SCHEMBL7990904 0.81 RXFP1 (0.43) KDM4EALDH1A1GAAKMT2ALMNA
SCHEMBL7989019 0.81 LMNA (0.54) LMNAHTTUSP2ALOX5PPARG
Oxalic Acid SCHEMBL7994745 0.80 GAA (0.46) KDM4EALDH1A1GAAKMT2ALMNA
SCHEMBL7971497 0.79 MAPT (0.46) ALDH1A1GAAKMT2ALMNAHTT
SCHEMBL224970 0.79 LMNA (0.50) KDM4EKMT2ALMNAHTTMRGPRX4
SCHEMBL8795871 0.79 GGPS1 (0.37)
SCHEMBL4387266 0.78 CHRM5 (0.37)

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-6248765-B1 ANTIINFLAMMATORY AGENTS; HYPOTENSIVE AGENTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICAL (FR) 2001-06-19 US disclosed