Oxalic Acid

Oxalic Acid

SCHEMBL9986807

C[C@H]1CCCN(CCCOc2ccc(-c3ccncc3)cc2)C1.O=C(O)C(=O)O.O=C(O)C(=O)O

nearest known ligand 0.73

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
HRH3 Q9Y5N1 16/20 0.73
KDM4E B2RXH2 3/20 0.67
ALDH1A1 P00352 3/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
HRH2 P25021 1/20 0.66
HRH1 P35367 1/20 0.66
LMNA P02545 1/20 0.65

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
SCHEMBL4096055 0.94 HRH3 (0.78) HRH3KDM4EALDH1A1SMN1; SMN2HRH2
SCHEMBL12061358 0.94 HRH3 (0.78) HRH3KDM4EALDH1A1SMN1; SMN2HRH2
SCHEMBL4098927 0.94 HRH3 (0.78) HRH3KDM4EALDH1A1SMN1; SMN2HRH2
Water SCHEMBL25381550 0.93 HRH3 (0.76) HRH3KDM4EALDH1A1SMN1; SMN2HRH2
Water SCHEMBL25381549 0.93 HRH3 (0.76) HRH3KDM4EALDH1A1SMN1; SMN2HRH2
Oxalic Acid SCHEMBL20509708 0.85 HRH3 (0.71) HRH3KDM4EALDH1A1SMN1; SMN2HRH2
Oxalic Acid SCHEMBL4596486 0.85 HRH3 (0.71) HRH3KDM4EALDH1A1SMN1; SMN2HRH2
Oxalic Acid SCHEMBL20509707 0.85 HRH3 (0.71) HRH3KDM4EALDH1A1SMN1; SMN2HRH2
Oxalic Acid SCHEMBL4595185 0.85 HRH3 (0.71) HRH3KDM4EALDH1A1SMN1; SMN2HRH2
SCHEMBL4095149 0.85 HRH3 (1.00) HRH3KDM4EALDH1A1SMN1; SMN2HRH2

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-8076329-B2 Histamine H3-receptor ligands and their therapeutic applications BIOPROJET (FR) 2011-12-13 US claimed