Oxalic Acid

Oxalic Acid

SCHEMBL25199732

O=C(O)C(=O)O.O=S(=O)(O)c1cccc2c(S(=O)(=O)O)cccc12

nearest known ligand 0.64

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
TTR P02766 2/20 0.64
CYP1A2 P05177 3/20 0.56
APEX1 P27695 1/20 0.50
AURKA O14965 1/20 0.46
AURKB Q96GD4 1/20 0.46
CDK2 P24941 2/20 0.45
CHAT P28329 1/20 0.44
SNCA P37840 1/20 0.44
MEN1 O00255 1/20 0.42
NSD2 O96028 1/20 0.42
POLB P06746 1/20 0.42
IDE P14735 1/20 0.42
DUSP3 P51452 1/20 0.42
CCR6 P51684 1/20 0.42
BLM P54132 1/20 0.42
KMT2A Q03164 1/20 0.42
COMT P21964 1/20 0.42
ATIC P31939 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL29363198 0.91 TTR (0.75) TTRCYP1A2APEX1AURKAAURKB
SCHEMBL6242 0.91 TTR (0.75) TTRCYP1A2APEX1AURKAAURKB
SCHEMBL30233642 0.91 TTR (0.75) TTRCYP1A2APEX1AURKAAURKB
Acetic Acid SCHEMBL5230930 0.89 TTR (0.62) TTRCYP1A2APEX1AURKAAURKB
SCHEMBL2290618 0.88 TTR (0.72) TTRCYP1A2APEX1AURKAAURKB
SCHEMBL8028660 0.88 TTR (0.72) TTRCYP1A2APEX1AURKAAURKB
Ammonia Solution, Strong SCHEMBL10954121 0.88 TTR (0.72) TTRCYP1A2APEX1AURKAAURKB
Lithium SCHEMBL18420655 0.88 TTR (0.72) TTRCYP1A2APEX1AURKAAURKB
Hydrochloric Acid SCHEMBL7455908 0.88 TTR (0.72) TTRCYP1A2APEX1AURKAAURKB
SCHEMBL460184 0.88 TTR (0.72) TTRCYP1A2APEX1AURKAAURKB

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
WO-2023083293-A1 PHARMACEUTICALLY ACCEPTABLE SALT OF ELIGLUSTAT AND CRYSTAL FORM THEREOF 曙方(上海)医药科技有限公司 2023-05-19 WO disclosed