Oxalic Acid

Oxalic Acid

SCHEMBL8894562

NCCCc1ccc(OCC=C(c2ccccc2)c2ccccc2)cc1.O=C(O)C(=O)O

nearest known ligand 0.54

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 5)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 12/20 0.54
PPARG P37231 10/20 0.53
PPARA Q07869 10/20 0.53
ESR1 P03372 2/20 0.45
FFAR1 O14842 2/20 0.44

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
SCHEMBL8893413 0.95 PPARD (0.52) PPARDPPARGPPARAESR1
SCHEMBL8699477 0.86 PPARD (0.54) PPARDPPARGPPARA
SCHEMBL6527568 0.74 PPARD (0.75) PPARDPPARGPPARAESR1FFAR1
Oxalic Acid SCHEMBL28079977 0.73 MAOA (0.68)
SCHEMBL6474346 0.72 PPARD (0.92) PPARDPPARGPPARA
SCHEMBL6474345 0.72 PPARD (0.92) PPARDPPARGPPARA
SCHEMBL6474343 0.72 PPARD (0.92) PPARDPPARGPPARA
SCHEMBL12442803 0.71 PPARD (0.55) PPARDPPARGPPARA
Oxalic Acid SCHEMBL31633759 0.71 TAAR1 (0.61)
SCHEMBL11332779 0.71 ALOX15 (0.53) PPARDPPARAFFAR1

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
WO-1997048674-A1 DIARYL ANTIMICROBIAL AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1997-12-24 WO disclosed