Oxalic Acid

Oxalic Acid

SCHEMBL28337441

CC(C)(C)N.O=C(O)C(=O)O

nearest known ligand 0.44

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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
ALDH1A1 P00352 2/20 0.44
TSHR P16473 2/20 0.44
LDHA P00338 1/20 0.40
LDHB P07195 1/20 0.40
FDPS P14324 1/20 0.37
MAPT P10636 1/20 0.36
PTGS1 P23219 1/20 0.36
GGT1 P19440 1/20 0.36
CYP2C19 P33261 2/20 0.36
ACHE P22303 1/20 0.36
FFAR3 O14843 1/20 0.36
LCK P06239 1/20 0.36
FYN P06241 1/20 0.36
HMGCR P04035 1/20 0.35
CHRM1 P11229 1/20 0.35
TBXA2R P21731 1/20 0.35
ADRA1A P35348 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GRM2 Q14416 1/20 0.35
ALOX15 P16050 2/20 0.33

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 SCHEMBL28337439 1.00 ALDH1A1 (0.44) ALDH1A1TSHRLDHALDHBFDPS
Tert-Butylamine SCHEMBL362032 0.87
Tert-Butylamine SCHEMBL14836204 0.87 ALDH1A1 (0.47) ALDH1A1TSHRLDHALDHBFDPS
Tert-Butylamine SCHEMBL27717339 0.83 FFAR3 (0.58) ALDH1A1TSHRFDPSMAPTPTGS1
Tert-Butylamine SCHEMBL27814396 0.83
Tert-Butylamine SCHEMBL289315 0.83
Tert-Butylamine SCHEMBL28670024 0.82
Tert-Butylamine SCHEMBL29006209 0.80 FFAR3 (0.54) ALDH1A1TSHRFDPSMAPTPTGS1
Pivalate SCHEMBL28262239 0.80 ALDH1A1 (0.50) ALDH1A1TSHRFDPSMAPTPTGS1
Deanol SCHEMBL11871103 0.79 MEN1 (0.37) ALDH1A1TSHRLDHALDHBGGT1

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
CN-104781731-B Positive-working light-sensitive material AZ电子材料卢森堡有限公司 2019-12-03 CN disclosed