Oxalic Acid

Oxalic Acid

SCHEMBL9518841

NC(CCCc1c(Cl)ccc2ccccc12)c1ccc(Cl)cc1.O=C(O)C(=O)O

nearest known ligand 0.38

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
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 2/20 0.38
HTT P42858 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CNR1 P21554 2/20 0.36
CNR2 P34972 1/20 0.36
UTS2R Q9UKP6 2/20 0.36
MCL1 Q07820 4/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
RECQL P46063 1/20 0.35
GAA P10253 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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 SCHEMBL9518835 1.00 MEN1 (0.38) MEN1KMT2ALMNAHTTNPSR1
Oxalic Acid SCHEMBL9613749 0.79 SCN4A (0.39) MEN1KMT2ALMNAHTTNPSR1
Oxalic Acid SCHEMBL9518842 0.75 KCNJ11 (0.38) MEN1KMT2ALMNAMAPTSMN1; SMN2
Oxalic Acid SCHEMBL9614031 0.74 KMT2A (0.52) MEN1KMT2AMCL1KDM4EALDH1A1
Oxalic Acid SCHEMBL9517855 0.74 KMT2A (0.48) KMT2AMCL1CYP1A2KDM4EALDH1A1
Oxalic Acid SCHEMBL9517848 0.74 KMT2A (0.48) KMT2AMCL1CYP1A2KDM4EALDH1A1
Oxalic Acid SCHEMBL9518051 0.72 KMT2A (0.42) MEN1KMT2ALMNAMCL1CYP1A2
Oxalic Acid SCHEMBL9518042 0.72 KMT2A (0.42) MEN1KMT2ALMNAMCL1CYP1A2
SCHEMBL10484268 0.68 MCL1 (0.35) MEN1KMT2AHTTMAPTSMN1; SMN2
SCHEMBL21010165 0.68 CYP2C9 (0.49) MEN1KMT2ALMNACYP1A2CYP3A4

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-0318234-B1 IMPROVEMENTS IN OR RELATING TO SELECTIVE SEROTONIN UPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 1993-03-17 EP disclosed
US-4876282-A ANTIDEPRESSANT, DIETETICS, ANTIALCOHOLISM AGENT ELI LILLY AND COMPANY (US) 1989-10-24 US disclosed