Oxalic Acid

Oxalic Acid

SCHEMBL4772880

CCN1CCN(c2nc(/C=C/c3ccc(OCCO)cc3)cc3ccoc23)CC1.O=C(O)C(=O)O

nearest known ligand 0.40

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 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
HRH3 Q9Y5N1 4/20 0.37
APP P05067 3/20 0.37
KDM4E B2RXH2 4/20 0.36
MCHR1 Q99705 3/20 0.36
GAA P10253 1/20 0.36
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35
TDP1 Q9NUW8 1/20 0.34

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 SCHEMBL4772888 1.00 ALDH1A1 (0.40) ALDH1A1KMT2AMEN1L3MBTL1MAPT
SCHEMBL4792970 0.96 MAPT (0.41) ALDH1A1KMT2AMEN1L3MBTL1MAPT
SCHEMBL4792963 0.96 MAPT (0.41) ALDH1A1KMT2AMEN1L3MBTL1MAPT
Oxalic Acid SCHEMBL4769349 0.86 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1L3MBTL1MAPT
Oxalic Acid SCHEMBL4769354 0.86 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1L3MBTL1MAPT
Oxalic Acid SCHEMBL4793452 0.85 ALDH1A1 (0.43) ALDH1A1KMT2AMEN1L3MBTL1MAPT
Oxalic Acid SCHEMBL4764765 0.84 MAPT (0.41) ALDH1A1KMT2AMEN1L3MBTL1MAPT
Oxalic Acid SCHEMBL4764768 0.84 MAPT (0.41) ALDH1A1KMT2AMEN1L3MBTL1MAPT
Oxalic Acid SCHEMBL6288735 0.82 ALDH1A1 (0.40) ALDH1A1KMT2AMEN1L3MBTL1MAPT
SCHEMBL4769370 0.81 KDM4E (0.38) ALDH1A1KMT2AMEN1MAPTKDM4E

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-1020445-B1 FUSED PYRIDINE DERIVATIVES EISAI R&D MAN CO LTD (JP) 2008-08-13 EP disclosed
US-6790844-B2 MUSCLE RELAXANTS; ANTISEROTONINE AGENT EISAI CO., LTD (JP) 2004-09-14 US disclosed
US-6340759-B1 ANTISPASMODIC AGENTS EISAI CO., LTD. (JP) 2002-01-22 US disclosed