Oxalic Acid

Oxalic Acid

SCHEMBL9787794

O=C(O)C(=O)O.OCC(CNCCc1ccc(O)cc1)c1ccccc1

nearest known ligand 0.52

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 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
KDM4E B2RXH2 2/20 0.52
GAA P10253 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
ADRB3 P13945 6/20 0.47
ADRB1 P08588 3/20 0.47
ADRB2 P07550 3/20 0.47
GPR55 Q9Y2T6 1/20 0.46
ALDH1A1 P00352 1/20 0.45
OPRK1 P41145 1/20 0.45

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
SCHEMBL10594495 0.94 ADRB2 (0.51) MEN1KMT2AKDM4EGAASMN1; SMN2
SCHEMBL10594284 0.85 ADRB2 (0.49) MEN1KMT2AKDM4EGAASMN1; SMN2
SCHEMBL9787801 0.82 ADRB3 (0.51) MEN1KMT2AKDM4EGAASMN1; SMN2
Alcohol SCHEMBL9787792 0.81 MEN1 (0.47) MEN1KMT2AKDM4EGAASMN1; SMN2
SCHEMBL9490616 0.80 ADRB3 (0.61) MEN1KMT2AKDM4EGAASMN1; SMN2
Hydrochloric Acid SCHEMBL9787770 0.79 ADRB3 (0.61) MEN1KMT2AKDM4EGAASMN1; SMN2
SCHEMBL5158059 0.78 TRPV1 (0.50) GAAALDH1A1OPRK1
Oxalic Acid SCHEMBL9787778 0.78 ADRB3 (0.55) MEN1KMT2AKDM4EGAASMN1; SMN2
SCHEMBL9543386 0.77 ADRB2 (0.73) KDM4EGAASMN1; SMN2TDP1ADRB3
SCHEMBL4467889 0.77 ADRB2 (0.73) KDM4EGAASMN1; SMN2TDP1ADRB3

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
US-5045567-A Propanolamine derivatives having anti-diabetic effects HOFFMANN-LA ROCHE INC. (US) 1991-09-03 US disclosed