Oxalic Acid

Oxalic Acid

SCHEMBL11229804

CCCCCN(CC)CCCCc1ccc([N+](=O)[O-])cc1.O=C(O)C(=O)O

nearest known ligand 0.85

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 8)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 6/20 0.85
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
THRA P10827 1/20 0.46
THRB P10828 1/20 0.46
HAO1 Q9UJM8 1/20 0.45
MAPT P10636 1/20 0.45

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 SCHEMBL11229795 1.00 KCNH2 (0.85) KCNH2ALDH1A1MEN1KMT2ATHRA
Oxalic Acid SCHEMBL11228144 0.99 KCNH2 (0.88) KCNH2ALDH1A1MEN1KMT2ATHRA
Oxalic Acid SCHEMBL11239421 0.99 KCNH2 (0.88) KCNH2ALDH1A1MEN1KMT2ATHRA
Oxalic Acid SCHEMBL11236561 0.99 KCNH2 (0.88) KCNH2ALDH1A1MEN1KMT2ATHRA
Oxalic Acid SCHEMBL11236570 0.99 KCNH2 (0.88) KCNH2ALDH1A1MEN1KMT2ATHRA
Oxalic Acid SCHEMBL11239410 0.99 KCNH2 (0.88) KCNH2ALDH1A1MEN1KMT2ATHRA
Oxalic Acid SCHEMBL11228148 0.99 KCNH2 (0.88) KCNH2ALDH1A1MEN1KMT2ATHRA
Oxalic Acid SCHEMBL11234803 0.95 KCNH2 (0.76) KCNH2ALDH1A1MEN1KMT2ATHRA
Oxalic Acid SCHEMBL11238448 0.94 KCNH2 (0.78) KCNH2ALDH1A1MEN1KMT2ATHRA
Oxalic Acid SCHEMBL11243792 0.94 KCNH2 (0.78) KCNH2ALDH1A1MEN1KMT2ATHRA

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
US-4336269-A ANTIARRHYTHMIA ELI LILLY AND COMPANY (US) 1982-06-22 US disclosed
US-4277501-A ANTIARRHYTHMIA AGENTS ELI LILLY AND COMPANY (US) 1981-07-07 US disclosed