Oxalic Acid

Oxalic Acid

SCHEMBL6561979

CC(N)C[C@H](Oc1ccc2sccc2c1)c1ccccc1.O=C(O)C(=O)O

nearest known ligand 0.42

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
SLC6A4 known ✓ P31645 2/20 0.36
MRGPRX4 Q96LA9 2/20 0.42
CTNNB1 P35222 3/20 0.41
WNT3A P56704 3/20 0.41
CA12 O43570 5/20 0.37
CA2 P00918 5/20 0.37
RAB9A P51151 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
IGLV6-57 P01721 1/20 0.35
SLC6A9 P48067 1/20 0.35
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34

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 SCHEMBL5869606 0.81 SLC6A4 (0.59) RAB9AMEN1KMT2ASLC6A4
Oxalic Acid SCHEMBL5869405 0.81 SLC6A4 (0.59) RAB9AMEN1KMT2ASLC6A4
SCHEMBL5869414 0.80 MRGPRX4 (0.41) MRGPRX4CTNNB1WNT3ACA12CA2
SCHEMBL5869614 0.80 MRGPRX4 (0.41) MRGPRX4CTNNB1WNT3ACA12CA2
Oxalic Acid SCHEMBL7315983 0.80 SLC6A4 (0.46) MEN1KMT2ASLC6A4SLC6A9
SCHEMBL5394251 0.79 HTR2A (0.45) RAB9ASLC6A4
SCHEMBL5869711 0.76 SLC6A4 (0.45) MRGPRX4CTNNB1WNT3ACA12CA2
SCHEMBL5869336 0.76 SLC6A4 (0.45) MRGPRX4CTNNB1WNT3ACA12CA2
SCHEMBL7049659 0.72 SLC6A4 (0.53) SLC6A4
SCHEMBL8559444 0.71 MRGPRX4 (0.45) MRGPRX4CTNNB1WNT3ACA12CA2

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-1397129-A1 HETEROARYLOXY 3-SUBSTITUTED PROPANAMINES S SEROTONIN AND NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2004-03-17 EP disclosed
WO-2002094262-A1 HETEROARYLOXY 3-SUBSTITUTED PROPANAMINES S SEROTONIN AND NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2002-11-28 WO disclosed