Oxalic Acid

Oxalic Acid

SCHEMBL6991838

CCCCCN1CC[C@@H](CCOc2ccc(Cl)cc2)[C@@H](OC)C1.O=C(O)C(=O)O

nearest known ligand 0.59

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
HRH3 Q9Y5N1 18/20 0.58
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52

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 SCHEMBL6994186 1.00 HRH3 (0.58) HRH3MEN1KMT2A
Oxalic Acid SCHEMBL6993011 0.91 HRH3 (0.48) HRH3KMT2A
Oxalic Acid SCHEMBL6995605 0.91 HRH3 (0.48) HRH3KMT2A
Oxalic Acid SCHEMBL6987195 0.90 RAB9A (0.53) HRH3KMT2A
Oxalic Acid SCHEMBL6997995 0.90 RAB9A (0.53) HRH3KMT2A
Oxalic Acid SCHEMBL6992880 0.90 KDM4E (0.53) HRH3MEN1KMT2A
Oxalic Acid SCHEMBL7087968 0.90 KDM4E (0.53) HRH3MEN1KMT2A
Oxalic Acid SCHEMBL6997680 0.90 KDM4E (0.53) HRH3MEN1KMT2A
Oxalic Acid SCHEMBL7087974 0.90 KDM4E (0.53) HRH3MEN1KMT2A
Oxalic Acid SCHEMBL6997413 0.90 HRH3 (0.61) HRH3

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