Oxalic Acid

Oxalic Acid

SCHEMBL9502626

CNCCC(Oc1ccc(NS(C)(=O)=O)cc1)c1ccccc1.O=C(O)C(=O)O

nearest known ligand 0.61

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 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 13/20 0.61
OPRM1 known ✓ P35372 1/20 0.55
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
CYP2D6 P10635 5/20 0.55
LMNA P02545 4/20 0.55
CYP3A4 P08684 4/20 0.55
SLC6A2 P23975 3/20 0.55
CYP2C19 P33261 3/20 0.55
CYP1A2 P05177 3/20 0.55
NPC1 O15118 2/20 0.55
MTOR P42345 2/20 0.55
RAB9A P51151 2/20 0.55
HTR2C P28335 2/20 0.55
SLC6A3 Q01959 2/20 0.55
TP53 P04637 2/20 0.55
ALOX15 P16050 2/20 0.55
TSHR P16473 2/20 0.55
THPO P40225 2/20 0.55
KDM4E B2RXH2 1/20 0.55

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 SCHEMBL16347641 0.83 SLC6A4 (0.71) SLC6A4MEN1KMT2ACYP2D6LMNA
SCHEMBL9499433 0.80 SLC6A4 (0.71) SLC6A4MEN1KMT2ACYP2D6LMNA
SCHEMBL9500916 0.80 SLC6A4 (0.58) SLC6A4HRH3
SCHEMBL32660752 0.79 SLC6A4 (0.69) SLC6A4MEN1KMT2ACYP2D6LMNA
Fluoxetine SCHEMBL8722258 0.79 SLC6A4 (0.88) SLC6A4MEN1KMT2ACYP2D6LMNA
SCHEMBL8197696 0.78 SLC6A4 (1.00) SLC6A4MEN1KMT2ACYP2D6LMNA
SCHEMBL5011928 0.78 SLC6A4 (1.00) SLC6A4MEN1KMT2ACYP2D6LMNA
Fluoxetine SCHEMBL7902052 0.78 SLC6A4 (0.86) SLC6A4MEN1KMT2ACYP2D6LMNA
SCHEMBL18744741 0.77 SLC6A4 (0.69) SLC6A4MEN1KMT2ACYP2D6LMNA
SCHEMBL9501028 0.77 SLC6A4 (0.69) SLC6A4MEN1KMT2ACYP2D6LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5238959-A For inhibiting serotonin uptake, antidepressant, suppression of alcoholism and obesity ELI LILLY AND COMPANY (US) 1993-08-24 US disclosed
EP-0336753-B1 IMPROVEMENTS IN OR RELATING TO PROPANAMINE DERIVATIVES ELI LILLY AND COMPANY (US) 1992-07-08 EP disclosed
EP-0336753-A1 Improvements in or relating to propanamine derivatives ELI LILLY AND COMPANY (US) 1989-10-11 EP disclosed