Oxalic Acid

Oxalic Acid

SCHEMBL9787785

CCOCCOc1ccc(CCNCC(CO)c2cccnc2)cc1.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 14)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 12/20 0.47
ADRB1 P08588 9/20 0.45
ADRB2 P07550 4/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
ITGB3 P05106 1/20 0.44
ITGB1 P05556 1/20 0.44
ITGAV P06756 1/20 0.44
ITGB6 P18564 1/20 0.44
ALDH1A1 P00352 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
Oxalic Acid SCHEMBL9787778 0.90 ADRB3 (0.55) ADRB3SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL9494415 0.85 ADRB3 (0.53) ADRB3ADRB2SMN1; SMN2MEN1KMT2A
SCHEMBL9494401 0.85 ADRB3 (0.53) ADRB3ADRB2SMN1; SMN2MEN1KMT2A
Oxalic Acid SCHEMBL9787807 0.84 ADRB3 (0.54) ADRB3ADRB1SMN1; SMN2MEN1KMT2A
SCHEMBL9782146 0.84 ADRB1 (0.58) ADRB3ADRB1ADRB2
Oxalic Acid SCHEMBL9787715 0.83 ADRB3 (0.49) ADRB3ADRB1SMN1; SMN2MEN1KMT2A
Oxalic Acid SCHEMBL9787821 0.82 ADRB3 (0.45) ADRB3ADRB1ADRB2SMN1; SMN2MEN1
Oxalic Acid SCHEMBL9787744 0.81 KDM4E (0.48) ADRB3ADRB1SMN1; SMN2MEN1KMT2A
Oxalic Acid SCHEMBL9787761 0.80 ADRB3 (0.45) ADRB3ADRB1ADRB2SMN1; SMN2MEN1
Alcohol SCHEMBL9787776 0.78 ADRB3 (0.51) ADRB3ADRB1SMN1; SMN2MEN1KMT2A

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