Oxalic Acid

Oxalic Acid

SCHEMBL7987116

Cc1ccc(OCCc2c[nH]cn2)cc1.O=C(O)C(=O)O

nearest known ligand 0.50

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 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.44
PPARD Q03181 1/20 0.43
PPARA Q07869 1/20 0.43
ATM Q13315 2/20 0.41
MCL1 Q07820 1/20 0.41
NPC1 O15118 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KCNH2 Q12809 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KCNA5 P22460 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL4394315 0.91 SMN1; SMN2 (0.50) L3MBTL1SMN1; SMN2MEN1KMT2AKCNH2
Oxalic Acid SCHEMBL7988348 0.84 SMN1; SMN2 (0.49) L3MBTL1SMN1; SMN2NPC1MEN1KMT2A
SCHEMBL7961178 0.82 HRH3 (0.58) L3MBTL1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL7974811 0.80 TDP1 (0.51) L3MBTL1KCNH2ALDH1A1
Oxalic Acid SCHEMBL7990912 0.80 MEN1 (0.47) L3MBTL1SMN1; SMN2PPARDPPARAMEN1
SCHEMBL4381007 0.80 SMN1; SMN2 (0.52) L3MBTL1SMN1; SMN2NPC1MEN1KMT2A
SCHEMBL7971202 0.80 MAPT (0.60) L3MBTL1SMN1; SMN2NPC1MEN1KMT2A
SCHEMBL7974440 0.80 GAA (0.56) L3MBTL1SMN1; SMN2PPARAMEN1KMT2A
SCHEMBL7971472 0.79 HRH3 (0.48) SMN1; SMN2ATMNPC1MEN1KMT2A
Oxalic Acid SCHEMBL7991422 0.79 HRH2 (0.39) SMN1; SMN2ALDH1A1KDM4E

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
WO-1996029315-A2 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1996-09-26 WO claimed
US-6248765-B1 ANTIINFLAMMATORY AGENTS; HYPOTENSIVE AGENTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICAL (FR) 2001-06-19 US disclosed