Oxalic Acid

Oxalic Acid

SCHEMBL27960034

N#C[C@@H]1CCCN1C(=O)CNCCN1CCN(c2ccc(F)cc2)C1=O.O=C(O)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

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 2)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 20/20 1.00
▸ DPP8 Q6V1X1 2/20 0.73

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 SCHEMBL27754513 1.00 DPP4 (1.00) DPP4DPP8
SCHEMBL27754602 0.98 DPP4 (0.96) DPP4DPP8
Oxalic Acid SCHEMBL28775288 0.92 DPP4 (1.00) DPP4DPP8
Oxalic Acid SCHEMBL27754783 0.92 DPP4 (1.00) DPP4DPP8
SCHEMBL28775267 0.91 DPP4 (0.98) DPP4DPP8
Oxalic Acid SCHEMBL28812915 0.90 DPP4 (1.00) DPP4DPP8
Oxalic Acid SCHEMBL27755073 0.90 DPP4 (1.00) DPP4DPP8
Oxalic Acid SCHEMBL28778774 0.89 DPP4 (0.82) DPP4DPP8
Oxalic Acid SCHEMBL27734489 0.89 DPP4 (0.82) DPP4DPP8
SCHEMBL27754926 0.88 DPP4 (0.97) DPP4DPP8

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
CN-102850330-B Method for preparing N-substituted pyrrolidine derivative through bromination DIAO PHARMACEUTICAL GROUP CO., LTD., CHENGDU (CN) 2014-10-15 — — CN disclosed
CN-102838589-B Method for preparing N substituted pyrrolidine derivative through acylation of methyl sulfone chloride CHENGDU DIAO PHARMACY GROUP CO LTD 2014-03-26 — — CN disclosed
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