Oxalic Acid

Oxalic Acid

SCHEMBL29067657

O=C(O)C(=O)O.O=C(O)C(=O)O.O=C=NSSN=C=O

nearest known ligand 0.00

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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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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 SCHEMBL28830590 0.92
Oxalic Acid SCHEMBL28835772 0.89
Oxalic Acid SCHEMBL28965127 0.87
Oxalic Acid SCHEMBL28835383 0.85
Oxalic Acid SCHEMBL28830645 0.85
Oxalic Acid SCHEMBL28830613 0.85
SCHEMBL1548514 0.83
Oxalic Acid SCHEMBL29900440 0.81
Oxalic Acid SCHEMBL29067662 0.81
Methane SCHEMBL28897899 0.79

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-115433234-A Bisphthalic acid phosphate, preparation method and application thereof 恒大新能源技术(深圳)有限公司 2022-12-06 CN disclosed