Oxalic Acid

Oxalic Acid

SCHEMBL7994745

FC(F)(F)c1cccc(SCCc2c[nH]cn2)c1.O=C(O)C(=O)O

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 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.46
POLB P06746 2/20 0.46
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 3/20 0.43
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GRK6 P43250 1/20 0.39
MAPT P10636 1/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
HSD17B10 Q99714 1/20 0.38
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
KMO O15229 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
SCHEMBL4386655 0.93 KDM4E (0.42) GAAPOLBKDM4EALDH1A1ATM
Oxalic Acid SCHEMBL7988233 0.81 HRH3 (0.41) POLBALDH1A1GRK6KMT2AMEN1
Oxalic Acid SCHEMBL7989028 0.80 ATM (0.42) GAAPOLBKDM4EALDH1A1ATM
Oxalic Acid SCHEMBL7990786 0.80 KDM4E (0.52) GAAKDM4EALDH1A1L3MBTL1KMT2A
Oxalic Acid SCHEMBL7990904 0.76 RXFP1 (0.43) GAAKDM4EALDH1A1L3MBTL1MAPT
SCHEMBL4379711 0.76 HRH3 (0.43) ALDH1A1GRK6KMT2AMEN1LMNA
SCHEMBL13636333 0.76 ALDH1A1 (0.47) ALDH1A1KMT2AMEN1LMNAHTT
SCHEMBL7994747 0.74 KDM4E (0.45) GAAPOLBKDM4EALDH1A1ATM
Oxalic Acid SCHEMBL7977323 0.74 HRH3 (0.43) POLBKDM4EALDH1A1GRK6KMT2A
SCHEMBL4379848 0.74 KMT2A (0.38) POLBKDM4EALDH1A1ATML3MBTL1

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