Oxalic Acid

Oxalic Acid

SCHEMBL5869405

CNCC[C@@H](Oc1ccc2sccc2c1)c1ccccc1.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 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 13/20 0.59
OPRM1 known ✓ P35372 1/20 0.50
SLC6A2 P23975 4/20 0.53
CYP2D6 P10635 3/20 0.53
NOS2 P35228 3/20 0.53
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
LMNA P02545 4/20 0.50
NPC1 O15118 2/20 0.50
CYP2C19 P33261 2/20 0.50
MTOR P42345 2/20 0.50
RAB9A P51151 2/20 0.50
CYP3A4 P08684 2/20 0.50
HTR2C P28335 2/20 0.50
SLC6A3 Q01959 2/20 0.50
KDM4E B2RXH2 1/20 0.50
TP53 P04637 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
ALOX15 P16050 1/20 0.50

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 1.00 SLC6A4 (0.59) SLC6A4SLC6A2CYP2D6NOS2MEN1
Hydrochloric Acid SCHEMBL5869234 0.85 SLC6A4 (0.59) SLC6A4SLC6A2CYP2D6MEN1KMT2A
Hydrochloric Acid SCHEMBL5869256 0.85 SLC6A4 (0.59) SLC6A4SLC6A2CYP2D6MEN1KMT2A
Oxalic Acid SCHEMBL6561979 0.81 MRGPRX4 (0.42) SLC6A4MEN1KMT2ARAB9A
SCHEMBL23521652 0.81 CACNA2D1 (0.67) SLC6A4SLC6A2CYP2D6KMT2ACYP2C19
SCHEMBL21742715 0.81 CACNA2D1 (0.67) SLC6A4SLC6A2CYP2D6KMT2ACYP2C19
SCHEMBL5869336 0.80 SLC6A4 (0.45) SLC6A4SLC6A2SLC6A3KCNK2KCNH2
SCHEMBL5869711 0.80 SLC6A4 (0.45) SLC6A4SLC6A2SLC6A3KCNK2KCNH2
SCHEMBL5869414 0.79 MRGPRX4 (0.41) SLC6A4MEN1KMT2A
SCHEMBL5869614 0.79 MRGPRX4 (0.41) SLC6A4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7037932-B2 Heteroaryloxy 3-substituted propanamines as serotonin and norepinephrine reuptake inhibitors ELI LILLY AND COMPANY (US) 2006-05-02 US disclosed
EP-1397129-B1 HETEROARYLOXY 3-SUBSTITUTED PROPANAMINES S SEROTONIN AND NOREPINEPHRINE REUPTAKE INHIBITORS LILLY CO ELI (US) 2005-11-16 EP disclosed
US-20040176435-A1 Heteroaryloxy 3-substituted propanamines s serotonin and norepinephrine reuptake inhibitors ELI LILLY AND COMPANY 2004-09-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040176435-A1 Heteroaryloxy 3-substituted propanamines s serotonin and norepinephrine reuptake inhibitors ADRA2C, ADRB1, TPH1 SLC6A4 7/4885OPRM1 23/4885SLC6A2 5/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.