Oxalic Acid

Oxalic Acid

SCHEMBL5157524

O=C(O)C(=O)O.OCCCc1c[nH]cn1

nearest known ligand 0.00

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Carbamic Acid SCHEMBL2661145 0.91 CPB2 (0.32)
Hydrochloric Acid SCHEMBL4381062 0.89
SCHEMBL1258619 0.85 TLR7 (0.33)
SCHEMBL18906027 0.80 SMN1; SMN2 (0.41)
Hydrochloric Acid SCHEMBL11161336 0.79 TBXAS1 (0.41)
SCHEMBL291231 0.79 TBXAS1 (0.46)
SCHEMBL44883 0.78
SCHEMBL5322896 0.78 HRH4 (0.32)
Maleic Acid SCHEMBL2138427 0.77 KDM4E (0.33)
SCHEMBL26589771 0.77 TBXAS1 (0.49)

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
EP-1472232-B1 PROCESSES FOR PREPARING IMIDAZOLE DERIVATIVES AND SALTS THEREOF YUHAN CORP (KR) 2007-01-24 EP disclosed
EP-1472232-A4 PROCESSES FOR PREPARING IMIDAZOLE DERIVATIVES AND SALTS THEREOF YUHAN CORP (KR) 2006-02-01 EP disclosed
EP-1472232-A1 PROCESSES FOR PREPARING IMIDAZOLE DERIVATIVES AND SALTS THEREOF Yuhan Corporation (KR) 2004-11-03 EP disclosed
US-6706888-B2 REACTING A 3-HALOTETRAHYDROFURAN OR TETRAHYDROPYRAN COMPOUND WITH FORMAMIDINE OR ITS SALT IN THE PRESENCE OF A BASE TO PRODUCE A 3-(1H-IMIDAZOL-4-YL)PROPANOL DERIVATIVE; EFFICIENCY; INTERMEDIATES; ANTICARCINOGENIC AGENTS; VIRICIDES; YUHAN CORPORATION (KR) 2004-03-16 US disclosed
US-20030153769-A1 Processes for preparing imidazole derivatives and salts thereof YUHAN CORPORATION 2003-08-14 US disclosed
WO-2003066600-A1 PROCESSES FOR PREPARING IMIDAZOLE DERIVATIVES AND SALTS THEREOF YUHAN CORPORATION (KR) 2003-08-14 WO disclosed