Oxalic Acid

Oxalic Acid

SCHEMBL4394339

O=C(O)C(=O)O.Oc1cccc(OCCCc2c[nH]cn2)c1

nearest known ligand 0.45

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 19)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.42
CNR2 P34972 2/20 0.42
CHRNB2 P17787 1/20 0.42
CHRNA4 P43681 1/20 0.42
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40
DRD3 P35462 1/20 0.40
GPR84 Q9NQS5 1/20 0.40
KDM4E B2RXH2 6/20 0.39
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
NSD2 O96028 1/20 0.38

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
SCHEMBL4383478 0.94 CHRNB2 (0.47) CNR1CNR2CHRNB2CHRNA4DRD2
Oxalic Acid SCHEMBL7990786 0.83 KDM4E (0.52) KDM4EALDH1A1KMT2A
SCHEMBL4394341 0.82 MCL1 (0.37) KDM4EALDH1A1SMN1; SMN2KMT2ANSD2
Oxalic Acid SCHEMBL4378004 0.81 MAOB (0.47) ALDH1A1KMT2AMEN1
Oxalic Acid SCHEMBL7987278 0.81 KMT2A (0.41) KDM4EALDH1A1SMN1; SMN2KMT2AMEN1
Oxalic Acid SCHEMBL7987283 0.81 KMT2A (0.41) KDM4EALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL4379687 0.80 KMT2A (0.50) ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL4383633 0.78 KMT2A (0.45) KMT2A
SCHEMBL7994413 0.78 HCAR2 (0.41)
SCHEMBL4381027 0.77 MAOA (0.46) KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0760811-B1 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 MODULATORS INST NAT SANTE RECH MED (FR) 2009-11-18 EP disclosed
US-6248765-B1 ANTIINFLAMMATORY AGENTS; HYPOTENSIVE AGENTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICAL (FR) 2001-06-19 US disclosed
EP-0760811-A1 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H 3? (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1997-03-12 EP disclosed
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 disclosed