Oxalic Acid

Oxalic Acid

SCHEMBL7526570

Clc1cccc(CN2CCN(c3ccc4c(c3)OCCO4)CC2)c1.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
DRD2 P14416 4/20 0.60
DRD4 P21917 4/20 0.60
DRD3 P35462 4/20 0.60
CYP2D6 P10635 1/20 0.57
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
ATM Q13315 1/20 0.55
HTR1A P08908 1/20 0.53
HTR7 P34969 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
MAPT P10636 2/20 0.53
TSHR P16473 1/20 0.53
ALDH1A1 P00352 2/20 0.53
PKM P14618 2/20 0.53
LMNA P02545 2/20 0.52
POLB P06746 1/20 0.52
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
HTT P42858 1/20 0.50
AIMP2 Q13155 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
SCHEMBL7517306 0.93 DRD2 (0.67) DRD2DRD4DRD3CYP2D6HTR1A
Oxalic Acid SCHEMBL7528961 0.89 DRD4 (0.68) DRD2DRD4DRD3CYP2D6KMT2A
Oxalic Acid SCHEMBL7521922 0.84 DRD2 (0.59) DRD2DRD4DRD3CYP2D6MEN1
Hydrochloric Acid SCHEMBL7525468 0.84 DRD4 (0.74) DRD2DRD4DRD3CYP2D6MEN1
Oxalic Acid SCHEMBL7523502 0.83 DRD2 (0.86) DRD2DRD4DRD3CYP2D6MEN1
Oxalic Acid SCHEMBL7532474 0.83 DRD2 (0.67) DRD2DRD4DRD3CYP2D6MEN1
Oxalic Acid SCHEMBL7524840 0.81 ALDH1A1 (0.57) DRD2DRD4DRD3CYP2D6MEN1
SCHEMBL7518794 0.81 DRD4 (0.78) DRD2DRD4DRD3CYP2D6HTR1A
Oxalic Acid SCHEMBL7523549 0.80 DRD4 (0.63) DRD2DRD4DRD3CYP2D6MEN1
SCHEMBL9374413 0.77 SIGMAR1 (0.76) DRD2DRD4DRD3HTR1AHTR7

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 DRD2 9/4885DRD4 28/4885DRD3 22/4885
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 DRD2 7/4885DRD4 28/4885DRD3 21/4885

“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.