Oxalic Acid

Oxalic Acid

SCHEMBL7965054

Cc1ccc(S(=O)(=O)Nc2ccc(NN)c(C(C)C)c2)cc1.O=C(O)C(=O)O

nearest known ligand 0.50

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
ALDH1A1 P00352 5/20 0.50
LMNA P02545 3/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
GAA P10253 2/20 0.50
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
POLB P06746 2/20 0.48
PKM P14618 1/20 0.48
MAPT P10636 3/20 0.47
HPGD P15428 1/20 0.47
PTPRC P08575 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
RECQL P46063 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HSD17B10 Q99714 1/20 0.45
KDM4E B2RXH2 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
SCHEMBL7402012 0.94 ALDH1A1 (0.52) ALDH1A1LMNAMEN1KMT2AGAA
SCHEMBL7400463 0.78 FFAR4 (0.61) ALDH1A1LMNAMEN1KMT2AGAA
Oxalic Acid SCHEMBL7981248 0.77 LMNA (0.54) ALDH1A1LMNAMEN1KMT2AGAA
SCHEMBL7400836 0.76 PTPRC (0.48) ALDH1A1LMNAKMT2AGAAPOLB
SCHEMBL14403378 0.75 ALDH1A1 (0.60) ALDH1A1LMNAMEN1KMT2AGAA
Bromide SCHEMBL7981260 0.75 PTPRC (0.47) ALDH1A1LMNAKMT2AGAAPOLB
SCHEMBL7981480 0.70 CA1 (0.40) ALDH1A1LMNAGAAMAPTCA12
SCHEMBL7401941 0.70 LMNA (0.60) ALDH1A1LMNAMEN1KMT2APOLB
SCHEMBL21773313 0.69 MAPT (0.70) ALDH1A1LMNAMEN1KMT2ACRHBP
SCHEMBL26028406 0.69 TRPA1 (0.45) LMNA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6172239-B1 PSYCHOLOGICAL, NERVOUS SYSTEM DISORDERS SANOFI (FR) 2001-01-09 US disclosed
US-5965579-A ANTAGONISTS OF THE NEUROTENSIN RECEPTORS; INCREASING AFFINITY FOR HUMAN NEUROTENSIN RECEPTORS SANOFI (FR) 1999-10-12 US disclosed
US-5939449-A NOVEL COMPOUNDS HAVING HIGH AFFINITY FOR THE NEUROTENSIN RECEPTORS SANOFI (FR) 1999-08-17 US disclosed
US-5936123-A COMPOUNDS SUCH AS 3-ISOPROPYL-4-HYDRAZINOBENZOIC ACID AND ITS SALTS SANOFI (FR) 1999-08-10 US disclosed
US-5925661-A NERVOUS SYSTEM DISORDERS SANOFI (FR) 1999-07-20 US disclosed
US-5723483-A NEUROTENSIN ANTAGONIST, HYPOTENSIVE AGENTS AND FOR NEUROPSYCHIATRIC DISORDERS SANOFI (FR) 1998-03-03 US disclosed