Oxalic Acid

Oxalic Acid

SCHEMBL6978397

Fc1ccc(-c2n[nH]cc2CCN2CCC(=Cc3ccccc3F)CC2)cc1.O=C(O)C(=O)O

nearest known ligand 0.37

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 12)

geneUniProtsupporting neighboursconfidence
PRCP P42785 2/20 0.37
HRH3 Q9Y5N1 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
KDM4E B2RXH2 1/20 0.34
CACNA1G O43497 1/20 0.34
CNR1 P21554 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR7 P34969 1/20 0.33
HTR6 P50406 1/20 0.33

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 SCHEMBL6969996 0.82 KMT2A (0.46) HRH3ALDH1A1MAPTKDM4EHTR2A
SCHEMBL6978399 0.79 ALDH1A1 (0.35) PRCPALDH1A1MAPTKDM4ECNR1
SCHEMBL6970002 0.76 HTR2A (0.34) HRH3ALDH1A1MAPTSIGMAR1CACNA1G
Hydrochloric Acid SCHEMBL6976894 0.76 HRH3 (0.36) HRH3ALDH1A1MAPTSIGMAR1KDM4E
SCHEMBL6983235 0.75 ALDH1A1 (0.39) PRCPHRH3ALDH1A1MAPTKDM4E
SCHEMBL16986122 0.73 MPO (0.47) HRH3ALDH1A1MAPTSIGMAR1KDM4E
SCHEMBL16986138 0.72 KDM4E (0.51) ALDH1A1MAPTKDM4EHTR2AHTR2C
Hydrochloric Acid SCHEMBL6982867 0.72 KDM4E (0.44) HRH3ALDH1A1MAPTKDM4ECNR1
Hydrochloric Acid SCHEMBL16986208 0.71 MPO (0.45) HRH3ALDH1A1MAPTSIGMAR1KDM4E
Hydrochloric Acid SCHEMBL16986190 0.71 KDM4E (0.50) ALDH1A1MAPTKDM4E

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 4 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
EP-1065205-A1 HETEROAROMATIC DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD (JP) 2001-01-03 EP disclosed