Oxalic Acid

Oxalic Acid

SCHEMBL9517865

Cc1cccc(C(CCc2cccc3ccccc23)N(C)C)c1.O=C(O)C(=O)O

nearest known ligand 0.46

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 19)

geneUniProtsupporting neighboursconfidence
OPRM1 known ✓ P35372 4/20 0.46
SLC6A4 known ✓ P31645 1/20 0.38
KMT2A Q03164 2/20 0.45
OPRD1 P41143 2/20 0.43
KDM4E B2RXH2 2/20 0.42
METAP2 P50579 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
MCL1 Q07820 2/20 0.40
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 1/20 0.39
NLRP3 Q96P20 1/20 0.39
MTNR1A P48039 2/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA4 P43681 1/20 0.39
SLC6A2 P23975 1/20 0.38
LMNA P02545 1/20 0.38

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 SCHEMBL9517863 1.00 OPRM1 (0.46) OPRM1KMT2AOPRD1KDM4EMETAP2
Oxalic Acid SCHEMBL9520787 0.90 KMT2A (0.50) OPRM1KMT2AOPRD1KDM4EMETAP2
Oxalic Acid SCHEMBL9520785 0.90 KMT2A (0.50) OPRM1KMT2AOPRD1KDM4EMETAP2
SCHEMBL10484168 0.84 CYP1A2 (0.49) OPRM1KMT2AOPRD1METAP2TDP1
Oxalic Acid SCHEMBL9519026 0.83 OPRM1 (0.48) OPRM1KMT2AOPRD1KDM4EMETAP2
Oxalic Acid SCHEMBL9519031 0.83 OPRM1 (0.48) OPRM1KMT2AOPRD1KDM4EMETAP2
Oxalic Acid SCHEMBL9613710 0.81 KMT2A (0.53) OPRM1KMT2AOPRD1KDM4ETDP1
SCHEMBL9517273 0.76 CYP1A2 (0.46) OPRM1KMT2AOPRD1METAP2MCL1
Cadaverine Tartrate SCHEMBL9518089 0.75 METAP2 (0.47) OPRM1KMT2AOPRD1METAP2TDP1
Cadaverine Tartrate SCHEMBL9518091 0.75 METAP2 (0.47) OPRM1KMT2AOPRD1METAP2TDP1

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
EP-0318234-A2 Improvements in or relating to selective serotonin uptake inhibitors ELI LILLY AND COMPANY (US) 1989-05-31 EP disclosed