Oxalic Acid

Oxalic Acid

SCHEMBL7314749

CCOc1ccccc1OC(CCN(C)C)c1ccccc1.O=C(O)C(=O)O

nearest known ligand 0.56

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 9)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 2/20 0.48
KDM4E B2RXH2 3/20 0.56
ALDH1A1 P00352 2/20 0.56
SLC6A9 P48067 2/20 0.54
HRH3 Q9Y5N1 1/20 0.48
GLA P06280 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SLC6A2 P23975 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.45

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 SCHEMBL7317340 0.88 KDM4E (0.69) KDM4EALDH1A1SLC6A9SLC6A4HRH3
Oxalic Acid SCHEMBL7316393 0.87 SLC6A9 (0.51) KDM4EALDH1A1SLC6A9SLC6A4HRH3
Oxalic Acid SCHEMBL5033726 0.85 CYP1A2 (0.57) KDM4EALDH1A1SLC6A9SLC6A4HRH3
Oxalic Acid SCHEMBL7310142 0.84 SLC6A9 (0.51) KDM4EALDH1A1SLC6A9SLC6A4HRH3
Oxalic Acid SCHEMBL7306543 0.82 KDM4E (0.61) KDM4EALDH1A1SLC6A9SLC6A4HRH3
SCHEMBL21658557 0.81 SLC6A9 (0.53) KDM4EALDH1A1SLC6A9SLC6A4HRH3
Oxalic Acid SCHEMBL9824494 0.81 NOS2 (0.55) KDM4EALDH1A1SLC6A9SLC6A4HRH3
SCHEMBL7169436 0.81 SLC6A4 (0.52) SLC6A9SLC6A4HRH3SLC6A2
SCHEMBL6729778 0.80 SLC6A9 (0.64) SLC6A9SLC6A4HRH3SLC6A2
Maleic Acid SCHEMBL7315527 0.80 SLC6A9 (0.64) KDM4EALDH1A1SLC6A9SLC6A4HRH3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4626549-A Treatment of obesity with aryloxyphenylpropylamines ELI LILLY AND COMPANY (US) 1986-12-02 US disclosed
US-4314081-A ANTIDEPRESSANTS ELI LILLY AND COMPANY (US) 1982-02-02 US disclosed
US-4194009-A ANTIDEPRESSANT ELI LILLY AND COMPANY (US) 1980-03-18 US disclosed
US-4018895-A Aryloxyphenylpropylamines in treating depression ELI LILLY AND COMPANY (US) 1977-04-19 US disclosed