Oxalic Acid

Oxalic Acid

SCHEMBL9517855

NC(CCCc1cccc2ccccc12)c1ccccc1.O=C(O)C(=O)O

nearest known ligand 0.48

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
KMT2A Q03164 1/20 0.48
MTNR1A P48039 2/20 0.47
TDP1 Q9NUW8 2/20 0.46
MCL1 Q07820 3/20 0.45
SLC1A3 P43003 1/20 0.45
SLC1A2 P43004 1/20 0.45
SLC1A1 P43005 1/20 0.45
METAP2 P50579 1/20 0.44
CTNNB1 P35222 1/20 0.43
KDM4E B2RXH2 2/20 0.42
COPS5 Q92905 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.41

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 SCHEMBL9517848 1.00 KMT2A (0.48) KMT2AMTNR1ATDP1MCL1SLC1A3
SCHEMBL9518025 0.93 SIGMAR1 (0.46) MTNR1ATDP1MCL1SLC1A3SLC1A2
Oxalic Acid SCHEMBL9518042 0.89 KMT2A (0.42) KMT2AMTNR1ATDP1MCL1SLC1A3
Oxalic Acid SCHEMBL9518051 0.89 KMT2A (0.42) KMT2AMTNR1ATDP1MCL1SLC1A3
SCHEMBL8329891 0.84 MTNR1A (0.44) MTNR1ATDP1SLC1A3SLC1A2SLC1A1
SCHEMBL5322260 0.81 SLC1A3 (0.51) KMT2AMTNR1ATDP1MCL1SLC1A3
Oxalic Acid SCHEMBL9517875 0.80 KMT2A (0.51) KMT2AMTNR1ATDP1MCL1KDM4E
Oxalic Acid SCHEMBL9519026 0.80 OPRM1 (0.48) KMT2AMTNR1ATDP1MCL1METAP2
Oxalic Acid SCHEMBL9519031 0.80 OPRM1 (0.48) KMT2AMTNR1ATDP1MCL1METAP2
Oxalic Acid SCHEMBL9517878 0.80 KMT2A (0.51) KMT2AMTNR1ATDP1MCL1KDM4E

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