Oxalic Acid

Oxalic Acid

SCHEMBL9628716

CCCCCCCCCNC(=O)Oc1ccc2c(c1)C(CN(CCC)CCC)CO2.O=C(O)C(=O)O

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
ACHE P22303 8/20 0.46
MGLL Q99685 2/20 0.44

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
SCHEMBL10460567 0.97 ACHE (0.48) ACHEMGLL
Oxalic Acid SCHEMBL9628990 0.84 ACHE (0.39) ACHE
SCHEMBL9628700 0.81 ACHE (0.49) ACHE
SCHEMBL9628089 0.81 ACHE (0.41) ACHE
SCHEMBL9628742 0.79 TP53 (0.41) ACHE
SCHEMBL9627777 0.78 PPARG (0.37) ACHE
SCHEMBL10460568 0.77 MGLL (0.47) ACHEMGLL
SCHEMBL9627910 0.74 HTR1A (0.44)
SCHEMBL9627868 0.74 KMT2A (0.41)
SCHEMBL9628391 0.73 ALDH1A1 (0.41) ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0281261-B1 3-AMINOMETHYL DERIVATIVES OF INDANE, INDOLINE AND DIHYDROBENZOFURANE AND DIHYDROBENZOTHIOPHENE H. LUNDBECK A/S (DK) 1992-05-06 EP disclosed
EP-0281261-A2 3-Aminomethyl derivatives of indane, indoline and dihydrobenzofurane and dihydrobenzothiophene H. LUNDBECK A/S (DK) 1988-09-07 EP disclosed