Oxalic Acid

Oxalic Acid

SCHEMBL9823353

CCCC.CCCC.O=C(O)C(=O)O.O=C(O)C(=O)O

nearest known ligand 0.50

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
FFAR3 O14843 2/20 0.50
HDAC1 Q13547 2/20 0.50
HDAC2 Q92769 2/20 0.50
HDAC3 O15379 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
ALOX15 P16050 2/20 0.48
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
TDP1 Q9NUW8 5/20 0.42
CHRM1 P11229 1/20 0.42
AKR1A1 P14550 1/20 0.42
CHRM3 P20309 1/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
ADRA1A P35348 1/20 0.42
HRH1 P35367 1/20 0.42
DRD3 P35462 1/20 0.42
SLC6A3 Q01959 1/20 0.42
AKR1B1 P15121 1/20 0.42
GPR84 Q9NQS5 7/20 0.40

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 SCHEMBL16492423 1.00 FFAR3 (0.50) FFAR3HDAC1HDAC2HDAC3HDAC8
Oxalic Acid SCHEMBL5861494 1.00 FFAR3 (0.50) FFAR3HDAC1HDAC2HDAC3HDAC8
Butane SCHEMBL29197512 0.86 FFAR3 (0.54) FFAR3HDAC1HDAC2HDAC3HDAC8
Butane SCHEMBL28896048 0.86 FFAR3 (0.54) FFAR3HDAC1HDAC2HDAC3HDAC8
Butane SCHEMBL28409881 0.86 FFAR3 (0.54) FFAR3HDAC1HDAC2HDAC3HDAC8
Butane SCHEMBL40275 0.86 FFAR3 (0.54) FFAR3HDAC1HDAC2HDAC3HDAC8
Butane SCHEMBL1165212 0.86 FFAR3 (0.54) FFAR3HDAC1HDAC2HDAC3HDAC8
Butane SCHEMBL1329645 0.86 FFAR3 (0.54) FFAR3HDAC1HDAC2HDAC3HDAC8
Butane SCHEMBL21633593 0.86 FFAR3 (0.54) FFAR3HDAC1HDAC2HDAC3HDAC8
Butane SCHEMBL1716773 0.86

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-0409840-A4 BENZOTRIAZOLE AND OXANILIDE UV ABSORBER HYDRAZIDES 1991-09-04 EP disclosed
EP-0409840-A1 BENZOTRIAZOLE AND OXANILIDE UV ABSORBER HYDRAZIDES ELF ATOCHEM NORTH AMERICA, INC. (US) 1991-01-30 EP disclosed
WO-1990009369-A1 BENZOTRIAZOLE AND OXANILIDE UV ABSORBER HYDRAZIDES ATOCHEM NORTH AMERICA, INC. (US) 1990-08-23 WO disclosed