Oxalic Acid

Oxalic Acid

SCHEMBL7830370

O=C(O)C(=O)O.c1ccc2c(c1)NCCN2

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
MAPT P10636 4/20 0.48
KDM4E B2RXH2 4/20 0.48
GAA P10253 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
NPC1 O15118 2/20 0.48
RXFP1 Q9HBX9 1/20 0.48
RAB9A P51151 1/20 0.44
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 7/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
GMNN O75496 1/20 0.38
LMNA P02545 1/20 0.38
PMP22 Q01453 1/20 0.38
SIGMAR1 Q99720 1/20 0.36
DAO P14920 1/20 0.36
TSHR P16473 1/20 0.36
NAPRT Q6XQN6 1/20 0.36
ALOX15 P16050 1/20 0.36
CES2 O00748 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
Carbamic Acid SCHEMBL28135527 0.88 MAPT (0.47) MAPTKDM4EGAAMEN1KMT2A
Urea SCHEMBL974632 0.85 GAA (0.43) MAPTKDM4EGAAMEN1KMT2A
SCHEMBL123812 0.84 GAA (0.54) MAPTKDM4EGAAMEN1KMT2A
Hydrochloric Acid SCHEMBL7829799 0.81 GAA (0.52) MAPTKDM4EGAAMEN1KMT2A
Oxalic Acid SCHEMBL7825836 0.78 MAPT (0.56) MAPTKDM4EGAAMEN1KMT2A
Oxalic Acid SCHEMBL27314622 0.76 ALDH1A1 (0.76) MAPTKDM4EGAAMEN1KMT2A
Oxalic Acid SCHEMBL7835342 0.76 MAPT (0.50) MAPTKDM4EGAANPC1RAB9A
SCHEMBL7135119 0.76 CASP3 (0.38) MAPTKDM4EGAAMEN1KMT2A
SCHEMBL13495065 0.76 MEN1 (0.48) MAPTKDM4EGAAMEN1KMT2A
SCHEMBL8200265 0.76 MEN1 (0.48) MAPTKDM4EGAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1070054-A1 AMINE COMPOUNDS, THEIR PRODUCTION AND THEIR USE AS SOMATOSTATIN RECEPTOR ANTAGONISTS OR AGONISTS Takeda Chemical Industries, Ltd. (JP) 2001-01-24 EP disclosed
WO-1999052875-A1 AMINE COMPOUNDS, THEIR PRODUCTION AND THEIR USE AS SOMATOSTATIN RECEPTOR ANTAGONISTS OR AGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-21 WO disclosed