Oxalic Acid

Oxalic Acid

SCHEMBL9702858

CN1CCC=C(c2nc(-c3cccs3)no2)C1.O=C(O)C(=O)O

nearest known ligand 0.63

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 5)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 10/20 0.63
CHRM4 P08173 10/20 0.63
CHRM5 P08912 10/20 0.63
CHRM1 P11229 10/20 0.63
CHRM3 P20309 10/20 0.63

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 SCHEMBL9702846 1.00 CHRM2 (0.63) CHRM2CHRM4CHRM5CHRM1CHRM3
Oxalic Acid SCHEMBL9704025 0.83 CHRM2 (0.70) CHRM2CHRM4CHRM5CHRM1CHRM3
Oxalic Acid SCHEMBL9704011 0.83 CHRM2 (0.70) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9703123 0.80 NPC1 (0.47)
Oxalic Acid SCHEMBL9703130 0.78 NPC1 (0.48) CHRM2CHRM4CHRM5CHRM1CHRM3
Oxalic Acid SCHEMBL9703119 0.78 NPC1 (0.48) CHRM2CHRM4CHRM5CHRM1CHRM3
Oxalic Acid SCHEMBL10418873 0.78 CHRM2 (1.00) CHRM2CHRM4CHRM5CHRM1CHRM3
Oxalic Acid SCHEMBL10418867 0.78 CHRM2 (1.00) CHRM2CHRM4CHRM5CHRM1CHRM3
Oxalic Acid SCHEMBL7275929 0.75 CHRM2 (0.58) CHRM2CHRM4CHRM5CHRM1CHRM3
Oxalic Acid SCHEMBL10418514 0.75 CHRM2 (0.82) CHRM2CHRM4CHRM5CHRM1CHRM3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0259621-B1 PIPERIDINE COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1992-11-25 EP disclosed
US-4933353-A ALZHEIMER*S DISEASE A/S FERROSAN (DE) 1990-06-12 US disclosed
US-4837241-A TREATMENT OF ALZEHEIMER*S DISEASE A/S FERROSAN (DK) 1989-06-06 US disclosed
EP-0259621-A2 Piperidine compounds and their preparation and use NOVO NORDISK A/S (DK) 1988-03-16 EP disclosed