Oxalic Acid

Oxalic Acid

SCHEMBL6969996

Fc1ccc(-c2[nH]ncc2CCN2CCC(=Cc3ccccc3F)CC2)cc1.O=C(O)C(=O)O

nearest known ligand 0.46

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 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
MAPK1 P28482 2/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 3/20 0.41
POLB P06746 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GAA P10253 2/20 0.39
KDM4E B2RXH2 2/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KDM5B Q9UGL1 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
HRH3 Q9Y5N1 1/20 0.36
HTR2A P28223 1/20 0.36

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 SCHEMBL6978397 0.82 PRCP (0.37) ALDH1A1MAPTKDM4EHRH3HTR2A
SCHEMBL6970002 0.76 HTR2A (0.34) KMT2AALDH1A1MAPTHRH3HTR2A
SCHEMBL6978399 0.74 ALDH1A1 (0.35) KMT2AMAPK1MEN1L3MBTL1ALDH1A1
Hydrochloric Acid SCHEMBL6976894 0.74 HRH3 (0.36) KMT2AMAPK1MEN1LMNAL3MBTL1
SCHEMBL6983235 0.73 ALDH1A1 (0.39) L3MBTL1ALDH1A1MAPTPOLBGAA
Hydrochloric Acid SCHEMBL6982867 0.70 KDM4E (0.44) L3MBTL1ALDH1A1MAPTPOLBGAA
Hydrochloric Acid SCHEMBL6984682 0.68 DRD2 (0.58) KMT2AMEN1LMNAKDM4ESMN1; SMN2
SCHEMBL6975606 0.67 HTR1A (0.38) KMT2AALDH1A1MAPTHPGDHTR2A
SCHEMBL6975602 0.67 HTR1A (0.38) KMT2AALDH1A1MAPTHPGDHTR2A
SCHEMBL11037164 0.64 KDM4E (0.43) KMT2AMEN1LMNAL3MBTL1ALDH1A1

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-1065205-B1 HETEROAROMATIC DERIVATIVES TAISHO PHARMACEUTICAL CO LTD (JP) 2003-05-28 EP disclosed
EP-1207159-A1 Aromaheterocyclic derivatives as dopamine D4 receptor antagonists TAISHO PHARMACEUTICAL CO. LTD (JP) 2002-05-22 EP disclosed
US-6291467-B1 DOPAMINE D4 RECEPTOR ANTAGONIST COMPOUND HAVING AN ANTIPSYCHOTIC ACTION WITHOUT CAUSING EXTRAPYRAMIDAL DISEASES. TAISHO PHARMACEUTICAL CO., LTD. (JP) 2001-09-18 US disclosed