Oxalic Acid

Oxalic Acid

SCHEMBL8400503

COc1ccc2cc(C3(O)CCN(CCCOc4cccc5[nH]ccc45)CC3)ccc2c1.O=C(O)C(=O)O

nearest known ligand 0.49

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 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.49
DRD3 P35462 8/20 0.49
ALDH1A1 P00352 2/20 0.48
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.48
DRD4 P21917 6/20 0.47
KDM4E B2RXH2 1/20 0.45
HTR1A P08908 2/20 0.45
HRH3 Q9Y5N1 2/20 0.42
SLC6A1 P30531 1/20 0.42
SLC6A12 P48065 1/20 0.42
SLC6A11 P48066 1/20 0.42
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL8396403 0.96 MEN1 (0.49) DRD2DRD3ALDH1A1KMT2AMEN1
Oxalic Acid SCHEMBL8399088 0.92 HTR1A (0.48) DRD2DRD3ALDH1A1KMT2AMEN1
Oxalic Acid SCHEMBL8398992 0.92 DRD2 (0.44) DRD2DRD3ALDH1A1KMT2AMEN1
Oxalic Acid SCHEMBL8400124 0.90 DRD2 (0.43) DRD2DRD3ALDH1A1KMT2AMEN1
Oxalic Acid SCHEMBL8395281 0.89 DRD2 (0.42) DRD2DRD3ALDH1A1KMT2AMEN1
SCHEMBL8400527 0.88 HTR1A (0.50) DRD2DRD3ALDH1A1KMT2AMEN1
SCHEMBL8400183 0.88 DRD2 (0.43) DRD2DRD3ALDH1A1KMT2AMEN1
Oxalic Acid SCHEMBL8397820 0.87 HTR1A (0.60) DRD2DRD3HTR1A
SCHEMBL7883032 0.87 CCR1 (0.48) DRD2DRD3ALDH1A1KMT2AMEN1
SCHEMBL8793314 0.87 HTR1A (0.46) DRD2DRD3ALDH1A1KMT2ADRD4

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
US-5912256-A 0-(4-INDOLYLOXY)-3-(4-HYDROXY-4-NAPHTHYLPIPERIDIN-1-YL)PROPANE S ELI LILLY AND COMPANY (US) 1999-06-15 US disclosed
EP-0814084-A1 Indole derivatives as 5-HT1A antagonists and as inhibitors of serotonine reuptake ELI LILLY AND COMPANY (US) 1997-12-29 EP disclosed