Oxalic Acid

Oxalic Acid

SCHEMBL10367531

COC(=O)C1CN2CCC1C2.O=C(O)C(=O)O

nearest known ligand 0.90

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 7)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 known ✓ P31645 1/20 0.39
▸ CHRM1 P11229 3/20 0.45
▸ CHRM2 P08172 2/20 0.45
▸ CHRM4 P08173 2/20 0.45
▸ CHRM3 P20309 2/20 0.45
▸ SLC6A2 P23975 1/20 0.39
▸ SLC6A3 Q01959 1/20 0.39

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
SCHEMBL7266907 0.95 CHRM1 (0.49) CHRM1CHRM2CHRM4CHRM3
SCHEMBL10369501 0.93 CHRM1 (0.51) CHRM1CHRM2CHRM4CHRM3
SCHEMBL3314224 0.88 CHRM1 (0.40) CHRM1CHRM2CHRM4CHRM3
SCHEMBL6965129 0.85 CHRM2 (0.47) CHRM1CHRM2CHRM4CHRM3
Hydrochloric Acid SCHEMBL5200635 0.84 ALDH1A1 (0.49) CHRM1CHRM2CHRM4CHRM3
Oxalic Acid SCHEMBL10368075 0.80 CHRM2 (0.40) CHRM1CHRM2CHRM4CHRM3
SCHEMBL10368013 0.77 CHRM2 (0.41) CHRM1CHRM2CHRM4CHRM3
Oxalic Acid SCHEMBL7432773 0.76 CHRM2 (0.54) CHRM1CHRM2CHRM4CHRM3
Oxalic Acid SCHEMBL6626814 0.76 CHRM2 (0.54) CHRM1CHRM2CHRM4CHRM3
Oxalic Acid SCHEMBL7424442 0.76 CHRM2 (0.54) CHRM1CHRM2CHRM4CHRM3

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
EP-0398617-A2 Process for resolving 1-azabicyclo [2.2.1]heptane-3-carboxylates MERCK SHARP & DOHME LTD. (GB) 1990-11-22 — — EP disclosed
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