Oxalic Acid

Oxalic Acid

SCHEMBL7316888

CCCCCN1CCC(OCc2ccccc2)CC1.O=C(O)C(=O)O

nearest known ligand 0.66

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 15)

geneUniProtsupporting neighboursconfidence
BCHE P06276 10/20 0.66
CARM1 Q86X55 2/20 0.60
PRMT6 Q96LA8 2/20 0.60
TMEM97 Q5BJF2 1/20 0.60
SIGMAR1 Q99720 1/20 0.60
PRMT8 Q9NR22 1/20 0.60
HRH3 Q9Y5N1 1/20 0.60
KCNH2 Q12809 2/20 0.55
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 2/20 0.55
LMNA P02545 1/20 0.55
CHRM3 P20309 4/20 0.53
MEN1 O00255 1/20 0.52
TSHR P16473 1/20 0.52
KMT2A Q03164 1/20 0.52

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 SCHEMBL7322850 0.89 BCHE (0.62) BCHECARM1PRMT6TMEM97SIGMAR1
SCHEMBL22857053 0.84 CARM1 (0.72) BCHECARM1PRMT6TMEM97SIGMAR1
SCHEMBL4030124 0.83 BCHE (0.66) BCHECARM1PRMT6TMEM97SIGMAR1
SCHEMBL4024133 0.82 BCHE (0.62) BCHECARM1PRMT6TMEM97SIGMAR1
SCHEMBL31705842 0.81 CARM1 (0.64) BCHECARM1PRMT6TMEM97SIGMAR1
SCHEMBL7327185 0.81 CARM1 (0.68) BCHECARM1PRMT6TMEM97SIGMAR1
SCHEMBL4028855 0.80 BCHE (1.00) BCHECARM1PRMT6TMEM97SIGMAR1
SCHEMBL4021849 0.80 BCHE (0.65) BCHECARM1PRMT6TMEM97SIGMAR1
SCHEMBL5852484 0.79 KCNH2 (0.64) BCHEKCNH2KDM4EALDH1A1MEN1
SCHEMBL8646865 0.79 CARM1 (0.64) 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 3 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
CN-1061963-A Be used as the croak pyridine class of the 4-replacement of medicine SMITH KLINE FRENCH LAB (GB) 1992-06-17 CN 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