Oxalic Acid

Oxalic Acid

SCHEMBL6992364

CCCCCN1CC[C@@H](CCOc2ccccc2Cc2ccccc2)[C@@H](OC)C1.O=C(O)C(=O)O

nearest known ligand 0.48

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 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
HRH1 P35367 7/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
DRD1 P21728 4/20 0.47
DRD4 P21917 3/20 0.47
DRD5 P21918 3/20 0.47
DRD3 P35462 3/20 0.47
DRD2 P14416 2/20 0.47
ALDH1A1 P00352 3/20 0.44
MAPK1 P28482 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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 SCHEMBL6998099 1.00 KDM4E (0.48) KDM4EL3MBTL1HRH1MEN1KMT2A
Oxalic Acid SCHEMBL6992367 1.00 KDM4E (0.48) KDM4EL3MBTL1HRH1MEN1KMT2A
SCHEMBL8561183 0.95 HRH1 (0.51) KDM4EL3MBTL1HRH1MEN1KMT2A
SCHEMBL6993677 0.95 HRH1 (0.51) KDM4EL3MBTL1HRH1MEN1KMT2A
SCHEMBL6993882 0.95 HRH1 (0.51) KDM4EL3MBTL1HRH1MEN1KMT2A
SCHEMBL6993670 0.95 HRH1 (0.51) KDM4EL3MBTL1HRH1MEN1KMT2A
Oxalic Acid SCHEMBL6991632 0.86 ALDH1A1 (0.60) KDM4EL3MBTL1MEN1KMT2AALDH1A1
Oxalic Acid SCHEMBL6991637 0.86 ALDH1A1 (0.60) KDM4EL3MBTL1MEN1KMT2AALDH1A1
Oxalic Acid SCHEMBL6996118 0.86 MEN1 (0.43) KDM4EL3MBTL1MEN1KMT2AALDH1A1
Oxalic Acid SCHEMBL6994123 0.86 MEN1 (0.43) KDM4EL3MBTL1MEN1KMT2AALDH1A1

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-0853615-B1 PIPERIDINE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS NEUROSEARCH AS (DK) 2003-12-10 EP disclosed
US-5981539-A TREATMENT OF STROKE, ANOXIA, ISCHEMIA, MIGRAINE, PSYCHOSIS, EPILEPSY OR ANY OTHER CONVULSIVE DISORDER NEUROSEARCH A/S (DK) 1999-11-09 US disclosed