Oxalic Acid

Oxalic Acid

SCHEMBL5777380

O=C(O)C(=O)O.O=c1[nH]cccc1CN1CCC(CCc2ccccc2OCC2CCCCC2)CC1

nearest known ligand 0.41

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 9)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CCR8 P51685 1/20 0.38
CXCR4 P61073 1/20 0.38
PPARG P37231 1/20 0.38

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 SCHEMBL6896125 1.00 KCNH2 (0.41) KCNH2MEN1KMT2AMAPTKDM4E
Oxalic Acid SCHEMBL5780721 0.99 KCNH2 (0.42) KCNH2MEN1KMT2AMAPTKDM4E
SCHEMBL5780290 0.95 KCNH2 (0.42) KCNH2MAPTCXCR4
SCHEMBL5781590 0.94 KCNH2 (0.43) KCNH2MAPT
Oxalic Acid SCHEMBL5778829 0.93 MEN1 (0.46) KCNH2MEN1KMT2AMAPTKDM4E
Oxalic Acid SCHEMBL5782385 0.90 KDM4E (0.44) MEN1KMT2AKDM4EALDH1A1CXCR4
SCHEMBL5777663 0.87 CXCR4 (0.43) KCNH2MAPTCCR8CXCR4
Oxalic Acid SCHEMBL5779548 0.87 MEN1 (0.41) KCNH2MEN1KMT2AMAPTKDM4E
Oxalic Acid SCHEMBL6892216 0.87 MEN1 (0.40) KCNH2MEN1KMT2AMAPTKDM4E
Oxalic Acid SCHEMBL5779827 0.87 KCNH2 (0.47) KCNH2MEN1KMT2A

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
EP-1254904-B1 NOVEL PIPERIDINE COMPOUNDS AND DRUGS CONTAINING THE SAME EISAI CO LTD (JP) 2006-05-24 EP claimed
EP-1254904-B1 NOVEL PIPERIDINE COMPOUNDS AND DRUGS CONTAINING THE SAME EISAI CO LTD (JP) 2006-05-24 EP disclosed
US-6784192-B2 NA+ CHANNEL INHIBITORY ACTION IS USEFUL FOR THERAPY AND PREVENTION FOR EXAMPLE, ARRHYTHMIA, VARIOUS NEURALGIAS AND ANALGESIC EISAI CO., LTD. (JP) 2004-08-31 US disclosed
US-20030220368-A1 Novel piperidine compouds and drugs containing the same EISAI R&D MANAGEMENT CO., LTD. (JP) 2003-11-27 US disclosed
EP-1254904-A1 NOVEL PIPERIDINE COMPOUNDS AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-11-06 EP 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 (1 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-20030220368-A1 Novel piperidine compouds and drugs containing the same TRPV1, CACNA1D, KCND2 KCNH2 6/4885MEN1 3216/4885KMT2A 1308/4885

“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.