Oxalic Acid

Oxalic Acid

SCHEMBL7322850

CCCCCN1CCC(OCc2ccc(F)cc2)CC1.O=C(O)C(=O)O

nearest known ligand 0.62

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 8)

geneUniProtsupporting neighboursconfidence
BCHE P06276 9/20 0.62
CARM1 Q86X55 2/20 0.60
PRMT6 Q96LA8 2/20 0.60
CHRM3 P20309 4/20 0.47
TMEM97 Q5BJF2 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
PRMT8 Q9NR22 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47

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
SCHEMBL7327185 0.93 CARM1 (0.68) BCHECARM1PRMT6TMEM97SIGMAR1
Oxalic Acid SCHEMBL7316888 0.89 BCHE (0.66) BCHECARM1PRMT6CHRM3TMEM97
Oxalic Acid SCHEMBL7327098 0.83 SSTR5 (0.51) CHRM3HRH3
Oxalic Acid SCHEMBL9368372 0.80 CCR5 (0.48)
Oxalic Acid SCHEMBL9368757 0.78 SLC6A2 (0.45) BCHE
SCHEMBL4026157 0.77 BCHE (1.00) BCHE
Oxalic Acid SCHEMBL9528351 0.77 CHRNB4 (0.47)
SCHEMBL4025061 0.76 BCHE (0.64) BCHECARM1PRMT6CHRM3TMEM97
SCHEMBL4013732 0.76 CARM1 (0.54) BCHECARM1PRMT6
SCHEMBL4023008 0.76 BCHE (1.00) BCHECARM1PRMT6TMEM97SIGMAR1

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-0542846-A1 N-HYDROCARBYL-4-SUBSTITUTED PIPERIDINES, THEIR PREPARATION AND USE AS CALCIUM BLOCKING AGENTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1993-05-26 EP disclosed
WO-1992002502-A1 N-HYDROCARBYL-4-SUBSTITUTED PIPERIDINES, THEIR PREPARATION AND USE AS CALCIUM BLOCKING AGENTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1992-02-20 WO disclosed