Oxalic Acid

Oxalic Acid

SCHEMBL9613749

NC(CCOc1c(Cl)ccc2ccccc12)c1ccc(Cl)cc1.O=C(O)C(=O)O

nearest known ligand 0.39

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 1/20 0.34
SCN4A P35499 2/20 0.39
UTS2R Q9UKP6 1/20 0.38
KMT2A Q03164 3/20 0.38
LMNA P02545 2/20 0.38
HTT P42858 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MEN1 O00255 2/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
KCNH2 Q12809 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
RECQL P46063 1/20 0.37
CXCR2 P25025 1/20 0.37

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 SCHEMBL9614031 0.83 KMT2A (0.52) KMT2AMEN1MCL1SLC6A2SLC6A4
SCHEMBL9291964 0.82 KCNH2 (0.41) UTS2RKMT2ALMNAHTTNPSR1
Oxalic Acid SCHEMBL9518841 0.79 MEN1 (0.38) SCN4AUTS2RKMT2ALMNAHTT
Oxalic Acid SCHEMBL9518835 0.79 MEN1 (0.38) SCN4AUTS2RKMT2ALMNAHTT
Oxalic Acid SCHEMBL9613804 0.74 KMT2A (0.60) KMT2AMEN1MCL1
Oxalic Acid SCHEMBL9614065 0.72 KMT2A (0.53) KMT2AMEN1MAPTMCL1
SCHEMBL9613755 0.70 KCNH2 (0.39) KMT2ANPSR1MEN1MAPTSMN1; SMN2
Oxalic Acid SCHEMBL9613778 0.70 KMT2A (0.53) KMT2AMEN1MCL1SLC6A2SLC6A4
Oxalic Acid SCHEMBL9613947 0.69 KMT2A (0.49) KMT2AMEN1MCL1
Oxalic Acid SCHEMBL9613796 0.68 KMT2A (0.51) UTS2RKMT2AMEN1MCL1SLC6A2

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-5135947-A Treatment of depression, eating disorders, and alcoholism ELI LILLY AND COMPANY (US) 1992-08-04 US disclosed
EP-0288188-B1 1-PHENYL-3-NAPHTHALENYLOXY-PROPANAMINES ELI LILLY AND COMPANY (US) 1991-10-16 EP disclosed
EP-0288188-A1 1-Phenyl-3-naphthalenyloxy-propanamines ELI LILLY AND COMPANY (US) 1988-10-26 EP disclosed