Oxalic Acid

Oxalic Acid

SCHEMBL27886255

COc1cc(OC)cc(-n2ccn(CCNCC(=O)N3CCCC3C#N)c2=O)c1.O=C(O)C(=O)O

nearest known ligand 0.71

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 3)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 19/20 0.71
▸ DPP8 Q6V1X1 2/20 0.59
▸ PREP P48147 1/20 0.51

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 SCHEMBL27903122 0.90 DPP4 (0.71) DPP4DPP8
Oxalic Acid SCHEMBL27754785 0.88 DPP4 (0.67) DPP4DPP8
Oxalic Acid SCHEMBL27754514 0.86 DPP4 (0.68) DPP4DPP8
Oxalic Acid SCHEMBL27755075 0.85 DPP4 (0.70) DPP4DPP8
Oxalic Acid SCHEMBL27734490 0.84 DPP4 (0.55) DPP4DPP8
Oxalic Acid SCHEMBL27960029 0.83 DPP4 (1.00) DPP4DPP8PREP
Oxalic Acid SCHEMBL27886254 0.83 DPP4 (1.00) DPP4DPP8PREP
Oxalic Acid SCHEMBL27960037 0.81 DPP4 (0.66) DPP4DPP8
SCHEMBL27886262 0.81 DPP4 (0.97) DPP4DPP8PREP
Oxalic Acid SCHEMBL27734267 0.80 DPP4 (0.65) DPP4

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 3 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
CN-102850330-A Method for preparing N-substituted pyrrolidine derivative through bromination CHENGDU DIAO PHARMACY GROUP CO LTD 2013-01-02 — — CN disclosed
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