Oxalic Acid

Oxalic Acid

SCHEMBL6977629

Cc1c(C)c2c(c(C)c1N)CC(C)(CN1CCC(COC(c3ccccc3)c3ccccc3)CC1)O2.O=C(O)C(=O)O

nearest known ligand 0.43

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 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 12/20 0.39
SLC6A3 Q01959 12/20 0.39
SLC6A2 P23975 11/20 0.39
KCNA3 P22001 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
SCHEMBL6976596 0.96 KCNA3 (0.41) KCNA3
Oxalic Acid SCHEMBL6984815 0.92 SLC6A4 (0.50) SLC6A4SLC6A3SLC6A2
Oxalic Acid SCHEMBL6980816 0.90 SLC6A4 (0.45) SLC6A4SLC6A3SLC6A2
Oxalic Acid SCHEMBL6980644 0.88 GRM5 (0.42) SLC6A4SLC6A3SLC6A2
SCHEMBL6984905 0.87 KCNA3 (0.44) SLC6A4SLC6A3SLC6A2KCNA3
Oxalic Acid SCHEMBL6984301 0.84 SLC6A4 (0.53) SLC6A4SLC6A3SLC6A2
SCHEMBL6983930 0.83 CHRM2 (0.43) SLC6A4SLC6A3SLC6A2
Hydrochloric Acid SCHEMBL6984798 0.81 SMN1; SMN2 (0.43) SLC6A4SLC6A3SLC6A2
SCHEMBL7983728 0.81 CCR3 (0.33) SLC6A4
Oxalic Acid SCHEMBL6985362 0.81 BCHE (0.40) SLC6A4SLC6A3SLC6A2

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
EP-0923575-B1 CYCLIC ETHER COMPOUNDS AS SODIUM CHANNEL MODULATORS TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-03-12 EP disclosed
US-6172085-B1 CENTRAL NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-01-09 US disclosed