Oxalic Acid

Oxalic Acid

SCHEMBL8766533

O=C(O)C(=O)O.O=[N+]([O-])c1ccc2c(c1)C=CC(NC[C@H](O)c1cccc(Cl)c1)CC2

nearest known ligand 0.48

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 2)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 18/20 0.48
ADRB1 P08588 6/20 0.46

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 SCHEMBL8766526 1.00 ADRB3 (0.48) ADRB3ADRB1
Hydrochloric Acid SCHEMBL8765819 0.77 ADRB3 (0.64) ADRB3ADRB1
Hydrochloric Acid SCHEMBL8765810 0.77 ADRB3 (0.64) ADRB3ADRB1
Oxalic Acid SCHEMBL8766731 0.75 ADRB3 (0.42) ADRB3ADRB1
Hydrochloric Acid SCHEMBL8765911 0.73 ADRB3 (0.61) ADRB3ADRB1
Hydrochloric Acid SCHEMBL8765907 0.73 ADRB3 (0.61) ADRB3ADRB1
SCHEMBL8765757 0.73 GRIN2B (0.63)
SCHEMBL8765318 0.71 ADRB3 (0.41) ADRB3ADRB1
SCHEMBL11523799 0.69 GRIN2B (0.41)
Hydrochloric Acid SCHEMBL6134409 0.67 ADRB3 (0.77) ADRB3ADRB1

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
EP-0583485-B1 ETHANOLAMINE DERIVATIVES HAVING SYMPATHOMIMETIC AND ANTI-POLLAKIURIA ACTIVITIES FUJISAWA PHARMACEUTICAL CO (JP) 1997-08-13 EP disclosed
US-5387710-A Ethanolamine derivatives having sympathomimetic and anti-pollakiuria activities FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-02-07 US disclosed
WO-1993015041-A1 ETHANOLAMINE DERIVATIVES HAVING SYMPATHOMIMETIC AND ANTI-POLLAKIURIA ACTIVITIES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-08-05 WO disclosed