Oxalic Acid

Oxalic Acid

SCHEMBL29142244

CCCCn1cc[n+](C)c1.O=C(O)C(=O)O.[Br-]

nearest known ligand 0.77

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 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.70
MEN1 O00255 2/20 0.70
HSP90AA1 P07900 2/20 0.70
KMT2A Q03164 2/20 0.70
APAF1 O14727 1/20 0.70
NPC1 O15118 1/20 0.70
PLA2G1B P04054 1/20 0.70
MAPT P10636 1/20 0.70
MAPK1 P28482 1/20 0.70
HTT P42858 1/20 0.70
RAB9A P51151 1/20 0.70
NPSR1 Q6W5P4 1/20 0.70
ATG4B Q9Y4P1 1/20 0.70
LMNA P02545 1/20 0.42
FDPS P14324 14/20 0.42

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 SCHEMBL29142247 0.94 MEN1 (0.81) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Bicarbonate SCHEMBL28424269 0.93 SMN1; SMN2 (0.69) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Oxalic Acid SCHEMBL29142364 0.92 SMN1; SMN2 (0.59) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Oxalic Acid SCHEMBL29142245 0.92 MEN1 (0.59) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Oxalic Acid SCHEMBL29142291 0.92 SMN1; SMN2 (0.59) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Acetic Acid SCHEMBL29142232 0.90 SMN1; SMN2 (0.65) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Bicarbonate SCHEMBL2127082 0.90 MEN1 (0.65) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Oxalic Acid SCHEMBL29142372 0.90 SMN1; SMN2 (0.56) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Bromide SCHEMBL30954387 0.89 SMN1; SMN2 (0.85) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Bromide SCHEMBL232599 0.89 SMN1; SMN2 (0.85) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1

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
CN-117440991-A Polysiloxane composition 默克专利有限公司 2024-01-23 CN disclosed