Oxalic Acid

Oxalic Acid

SCHEMBL9538801

CCOCCn1c(CC2CCN(CCc3ccccn3)CC2)nc2cccnc21.O=C(O)C(=O)O.O=C(O)C(=O)O.O=C(O)C(=O)O

nearest known ligand 0.47

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 11)

geneUniProtsupporting neighboursconfidence
OPRM1 known ✓ P35372 1/20 0.40
SLC6A9 P48067 2/20 0.47
KDM4E B2RXH2 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 1/20 0.43
HRH1 P35367 8/20 0.42
ENPP2 Q13822 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HTR2A P28223 1/20 0.39
HTR4 Q13639 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
Oxalic Acid SCHEMBL9538798 1.00 SLC6A9 (0.47) SLC6A9KDM4ESMN1; SMN2LMNAHRH1
Oxalic Acid SCHEMBL9535426 0.87 SLC6A9 (0.49) SLC6A9KDM4ESMN1; SMN2LMNAHRH1
Oxalic Acid SCHEMBL9535422 0.87 SLC6A9 (0.49) SLC6A9KDM4ESMN1; SMN2LMNAHRH1
Oxalic Acid SCHEMBL9535399 0.85 SLC6A9 (0.47) SLC6A9KDM4ESMN1; SMN2LMNAHRH1
Oxalic Acid SCHEMBL9535391 0.85 SLC6A9 (0.47) SLC6A9KDM4ESMN1; SMN2LMNAHRH1
Fumaric Acid SCHEMBL10382780 0.83 SLC6A9 (0.49) SLC6A9KDM4ESMN1; SMN2LMNAHRH1
SCHEMBL9535014 0.83 SLC6A9 (0.55) SLC6A9KDM4ESMN1; SMN2LMNAHRH1
Fumaric Acid SCHEMBL9635834 0.83 SLC6A9 (0.58) SLC6A9KDM4ESMN1; SMN2LMNAENPP2
SCHEMBL9535554 0.82 SLC6A9 (0.52) SLC6A9KDM4ESMN1; SMN2LMNAHRH1
SCHEMBL9684843 0.82 SLC6A9 (0.64) SLC6A9KDM4EHRH1MEN1KMT2A

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
EP-0282133-B1 1-ALKYL SUBSTITUTED BENZIMIDAZOLE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1993-07-28 EP disclosed
US-4943580-A ANTIALLERGENS JANSSEN PHARMACEUTICA N.V. (BE) 1990-07-24 US disclosed