Oxalic Acid

Oxalic Acid

SCHEMBL8917045

CCc1oc2cc(F)ccc2c1C1CCN(CCc2sc3c(c2CC)CCN(C(C)=O)C3)CC1.O=C(O)C(=O)O

nearest known ligand 0.42

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 10)

geneUniProtsupporting neighboursconfidence
CTSS P25774 2/20 0.39
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HTR2A P28223 4/20 0.36
HTR7 P34969 4/20 0.36
DRD2 P14416 3/20 0.36
CCR3 P51677 6/20 0.35
KCNH2 Q12809 3/20 0.35
MCHR1 Q99705 2/20 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
Hydrochloric Acid SCHEMBL8916553 0.89 CTSS (0.39) CTSSTP53GAAMAPTHTR2A
Oxalic Acid SCHEMBL8991806 0.86 CTSS (0.40) CTSSTP53GAAMAPTHTR2A
Oxalic Acid SCHEMBL8919091 0.85 CTSS (0.43) CTSSTP53GAAMAPTCCR3
SCHEMBL8916164 0.84 CTSS (0.48) CTSSTP53GAAMAPTHTR2A
SCHEMBL8917865 0.84 MAPT (0.38) TP53GAAMAPTHTR2AHTR7
SCHEMBL8916920 0.84 CTSS (0.41) CTSSTP53GAAMAPTHTR2A
Hydrochloric Acid SCHEMBL8918060 0.83 CTSS (0.48) CTSSTP53GAAMAPTHTR2A
SCHEMBL8918089 0.83 DRD2 (0.54) HTR2AHTR7DRD2KCNH2
SCHEMBL8919136 0.83 CTSS (0.40) CTSSTP53GAAMAPTHTR2A
Oxalic Acid SCHEMBL8919160 0.82 TP53 (0.39) TP53GAAMAPTHTR2AHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691330-A ANTIPSYCHOTIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-11-25 US disclosed
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed