Oxalic Acid

Oxalic Acid

SCHEMBL10569733

CC(C)NCCCCOc1cccc2c1N(C(=O)c1cccnc1)CCC2.O=C(O)C(=O)O

nearest known ligand 0.48

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
POLB P06746 2/20 0.48
HSD17B10 Q99714 1/20 0.48
ALDH1A1 P00352 7/20 0.47
KDM4E B2RXH2 4/20 0.47
STAT3 P40763 1/20 0.40
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPSR1 Q6W5P4 2/20 0.39
PDGFRB P09619 1/20 0.37
KDR P35968 1/20 0.37
GAA P10253 2/20 0.37
MAPT P10636 2/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NAMPT P43490 2/20 0.37
PTGER4 P35408 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36

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 SCHEMBL10569361 0.97 POLB (0.48) POLBHSD17B10ALDH1A1KDM4ESTAT3
Oxalic Acid SCHEMBL10574298 0.95 POLB (0.49) POLBHSD17B10ALDH1A1KDM4ESTAT3
SCHEMBL10652857 0.95 POLB (0.51) POLBHSD17B10ALDH1A1KDM4ESTAT3
Oxalic Acid SCHEMBL10573991 0.86 POLB (0.48) POLBHSD17B10ALDH1A1KDM4ESTAT3
Oxalic Acid SCHEMBL10573320 0.85 POLB (0.48) POLBHSD17B10ALDH1A1KDM4ESTAT3
Oxalic Acid SCHEMBL10573986 0.84 POLB (0.47) POLBHSD17B10ALDH1A1KDM4ESTAT3
SCHEMBL10570434 0.83 POLB (0.50) POLBHSD17B10ALDH1A1STAT3LMNA
Hydrochloric Acid SCHEMBL10572689 0.83 POLB (0.55) POLBHSD17B10ALDH1A1STAT3LMNA
Nicainoprol SCHEMBL1816282 0.83 HSD17B10 (0.49) POLBHSD17B10ALDH1A1STAT3LMNA
SCHEMBL10573458 0.82 POLB (0.51) POLBHSD17B10ALDH1A1KDM4ESTAT3

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-4845099-A ANTIARRHYTHMIA AGENTS CASSELLA AKTIENGESELLSCHAFT (DE) 1989-07-04 US disclosed