Oxalic Acid

Oxalic Acid

SCHEMBL8057905

CCOc1ccccc1OCCNC(CC)S(=O)(=O)c1ccccc1.O=C(O)C(=O)O

nearest known ligand 0.53

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 20)

geneUniProtsupporting neighboursconfidence
OPRM1 known ✓ P35372 1/20 0.42
KDM4E B2RXH2 12/20 0.53
PKM P14618 1/20 0.53
ALDH1A1 P00352 5/20 0.52
TDP1 Q9NUW8 4/20 0.52
HTT P42858 1/20 0.52
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
LMNA P02545 1/20 0.46
HTR1A P08908 3/20 0.43
ADRA1D P25100 3/20 0.43
ADRA1A P35348 3/20 0.43
ADRA1B P35368 3/20 0.43
GLA P06280 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 1/20 0.42
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
ADRA2A P08913 1/20 0.42
DRD2 P14416 1/20 0.42

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
Hydrochloric Acid SCHEMBL8053961 0.80 ADRA1D (0.47) KDM4EPKMALDH1A1TDP1HTT
Oxalic Acid SCHEMBL8057898 0.74 ALDH1A1 (0.57) KDM4EALDH1A1TDP1HTTMEN1
SCHEMBL5284933 0.72 MMP1 (0.43) KMT2ALMNA
SCHEMBL27611534 0.70 MTNR1A (0.58) KDM4EPKMALDH1A1TDP1HTT
SCHEMBL7416446 0.69 GLA (0.47) KDM4EALDH1A1TDP1MEN1KMT2A
SCHEMBL20556306 0.69 ATM (0.51) ALDH1A1MEN1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL8053956 0.69 HTR1A (0.58) KDM4EALDH1A1MEN1KMT2AHTR1A
Oxalic Acid SCHEMBL10681297 0.68 MAPK1 (0.46) KDM4EPKMALDH1A1TDP1HTT
SCHEMBL6196730 0.68 MTNR1A (0.77) KDM4EPKMALDH1A1MEN1KMT2A
SCHEMBL27736013 0.68 HTR1A (0.53) KDM4EPKMALDH1A1TDP1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6051605-A TREATING PSYCHOSIS AND SCHIZOPHRENIA USING A COMPOUND THAT IS AN ANTAGONIST OF DOPAMINE D4 RECEPTORS WARNER-LAMBERT COMPANY (US) 2000-04-18 US disclosed