Oxalic Acid

Oxalic Acid

SCHEMBL5656929

COCc1cc2c(nc(C)n2C)c2c1CCC(c1ccccc1)O2.O=C(O)C(=O)O

nearest known ligand 0.35

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 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.35
ATP4A P20648 1/20 0.34
ATP4B P51164 1/20 0.34
LMNA P02545 2/20 0.33
BRD4 O60885 3/20 0.33
CREBBP Q92793 3/20 0.33
F2 P00734 1/20 0.32
SLC8A1 P32418 6/20 0.32
ALDH1A1 P00352 2/20 0.32
CYP19A1 P11511 1/20 0.32
HCRTR2 O43614 1/20 0.31

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
SCHEMBL4664625 0.95 ATP4A (0.36) RAB9AATP4AATP4BLMNABRD4
SCHEMBL5661208 0.87 ATP4A (0.34) ATP4AATP4BSLC8A1
SCHEMBL4662876 0.86 ATP4A (0.37) RAB9AATP4AATP4BLMNASLC8A1
SCHEMBL4964853 0.84 ADRA1A (0.31) SLC8A1
SCHEMBL6020045 0.82 DHODH (0.36) RAB9AATP4AATP4BSLC8A1CYP19A1
SCHEMBL6019450 0.82 DHODH (0.36) RAB9AATP4AATP4BSLC8A1CYP19A1
SCHEMBL4663178 0.82 DHODH (0.36) RAB9AATP4AATP4BSLC8A1CYP19A1
SCHEMBL4664632 0.81 ALDH1A1 (0.38) ATP4AATP4BLMNASLC8A1ALDH1A1
SCHEMBL5506543 0.80 RAB9A (0.35) RAB9AATP4AATP4BSLC8A1CYP19A1
SCHEMBL4666543 0.80 RAB9A (0.35) RAB9AATP4AATP4BSLC8A1

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-7307084-B2 Cyclic benzimidazoles ALTANA PHARMA AG (DE) 2007-12-11 US claimed