Oxalic Acid

Oxalic Acid

SCHEMBL9868440

CCCC(=O)OC1c2ccccc2C(=O)N1CCCN1CC=C(c2ccccc2)CC1.O=C(O)C(=O)O

nearest known ligand 0.46

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 12)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 3/20 0.46
▸ SIGMAR1 Q99720 3/20 0.44
▸ PARP1 P09874 4/20 0.41
▸ KDM4E B2RXH2 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ APEX1 P27695 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ S1PR1 P21453 1/20 0.39
▸ S1PR3 Q99500 1/20 0.39
▸ DRD3 P35462 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
Oxalic Acid SCHEMBL9868595 0.89 HTR1A (0.49) HTR1ASIGMAR1PARP1KDM4EALOX15
Oxalic Acid SCHEMBL9868038 0.89 HTR1A (0.47) HTR1ASIGMAR1PARP1S1PR1S1PR3
Oxalic Acid SCHEMBL9868441 0.88 HTR1A (0.50) HTR1ASIGMAR1PARP1KDM4EKMT2A
Oxalic Acid SCHEMBL9867563 0.87 HTR1A (0.51) HTR1ASIGMAR1PARP1DRD3
SCHEMBL9867799 0.87 HTR1A (0.51) HTR1ASIGMAR1PARP1
SCHEMBL9867198 0.87 HTR1A (0.53) HTR1ASIGMAR1PARP1KDM4EALOX15
Oxalic Acid SCHEMBL9866814 0.87 HTR1A (0.47) HTR1ASIGMAR1PARP1KDM4EALOX15
SCHEMBL9868604 0.84 HTR1A (0.54) HTR1ASIGMAR1PARP1
Oxalic Acid SCHEMBL9867890 0.83 HTR1A (0.53) HTR1ASIGMAR1PARP1
SCHEMBL9867083 0.83 HTR1A (0.55) HTR1ASIGMAR1PARP1

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
US-4999355-A Antiserotonine agents RHONE-POULENC (FR) 1991-03-12 — — US disclosed
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