Oxalic Acid

Oxalic Acid

SCHEMBL7524840

Clc1ccccc1CN1CCN(c2ccc3c(c2)OCCO3)CC1.O=C(O)C(=O)O

nearest known ligand 0.60

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 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.57
KDM4E B2RXH2 4/20 0.57
HTT P42858 1/20 0.57
GAA P10253 2/20 0.55
MAPT P10636 1/20 0.55
DRD2 P14416 4/20 0.55
DRD3 P35462 4/20 0.55
DRD4 P21917 3/20 0.55
RAB9A P51151 2/20 0.54
NPC1 O15118 1/20 0.54
PLA2G1B P04054 1/20 0.52
ATG4B Q9Y4P1 1/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
SIGMAR1 Q99720 2/20 0.50
HTR1A P08908 1/20 0.50
ADRA2A P08913 1/20 0.50
ADRA2C P18825 1/20 0.50
ADRA1D P25100 1/20 0.50
ADRA1A P35348 1/20 0.50

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
SCHEMBL7521522 0.93 ALDH1A1 (0.63) ALDH1A1KDM4EHTTGAAMAPT
Oxalic Acid SCHEMBL7519823 0.84 MEN1 (0.58) ALDH1A1KDM4EGAADRD2DRD3
Oxalic Acid SCHEMBL7528961 0.83 DRD4 (0.68) ALDH1A1KDM4EMAPTDRD2DRD3
Oxalic Acid SCHEMBL7526570 0.81 DRD2 (0.60) ALDH1A1HTTMAPTDRD2DRD3
Oxalic Acid SCHEMBL7532474 0.80 DRD2 (0.67) ALDH1A1KDM4EHTTDRD2DRD3
Oxalic Acid SCHEMBL7523502 0.80 DRD2 (0.86) ALDH1A1KDM4EMAPTDRD2DRD3
Hydrochloric Acid SCHEMBL7525468 0.80 DRD4 (0.74) ALDH1A1KDM4EDRD2DRD3DRD4
Oxalic Acid SCHEMBL7523549 0.77 DRD4 (0.63) ALDH1A1KDM4EMAPTDRD2DRD3
SCHEMBL7528437 0.76 DRD2 (0.64) ALDH1A1KDM4EHTTGAADRD2
SCHEMBL6032141 0.75 ALDH1A1 (0.73) ALDH1A1KDM4EHTTGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6486164-B2 USED FOR TREATMENT OF NEUROPSYCHOLOGICAL DISORDERS INCLUDING SCHIZOPHRENIA, MANIA, DEMENTIA, DEPRESSION, ANXIETY, COMPULSIVE BEHAVIOR, SUBSTANCE ABUSE, PARKINSON-LIKE MOTOR DISORDERS AND MOTION DISORDERS NEUROLEPTIC AGENTS. NEUROGEN CORPORATION 2002-11-26 US disclosed
US-20020099056-A1 6-(4-arylalkylpiperazin-1-yl) benzodioxane and 6-(4-arylalkypiperazin-1-yl) chromane derivatives: dopamine receptor subtype specific ligands NEUROGEN CORPORATION 2002-07-25 US disclosed
US-6333329-B2 USEFUL FOR TREATMENT AND/OR PREVENTION OF NEUROPSYCHOLOGICAL DISORDERS INCLUDING SCHIZOPHRENIA, MANIA, DEMENTIA, DEPRESSION, ANXIETY, COMPULSIVE BEHAVIOR, DRUG ABUSE, PARKINSON-LIKE MOTOR DISORDERS AND MOTION DISORDERS NEUROGEN CORPORATION 2001-12-25 US disclosed
US-20010005753-A1 6-(4-arylalkylpiperazin-1-yl) benzodioxane and 6-(4-arylalkylpiperazin-1-yl) chromane derivatives: dopamine receptor subtype specific ligands NEUROGEN CORPORATION 2001-06-28 US disclosed
US-6177566-B1 TREATMENT AND/OR PREVENTION OF NEUROPSYCHOLOGICAL DISORDERS NEUROGEN CORPORATION 2001-01-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010005753-A1 6-(4-arylalkylpiperazin-1-yl) benzodioxane and 6-(4-arylalkylpiperazin-1-yl) chromane derivatives: dopamine receptor subtype specific ligands CHRNA6, HTR2C, HTR3C ALDH1A1 291/4885KDM4E 3185/4885HTT 567/4885
US-20020099056-A1 6-(4-arylalkylpiperazin-1-yl) benzodioxane and 6-(4-arylalkypiperazin-1-yl) chromane derivatives: dopamine receptor subtype specific ligands CHRNA6, HTR3C, HTR2C ALDH1A1 287/4885KDM4E 3308/4885HTT 533/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.