Oxalic Acid

Oxalic Acid

SCHEMBL4772215

CCN1CCN(c2nc(-c3ccc(OC)c(CCCO)c3)cc3ccsc23)CC1.O=C(O)C(=O)O

nearest known ligand 0.36

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 18)

geneUniProtsupporting neighboursconfidence
MTOR P42345 5/20 0.36
PIK3CA P42336 2/20 0.36
KDM4E B2RXH2 5/20 0.35
ALDH1A1 P00352 4/20 0.35
HPGD P15428 3/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
MALT1 Q9UDY8 1/20 0.34
NEK2 P51955 1/20 0.34
RECQL P46063 1/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
ACHE P22303 1/20 0.34
SYK P43405 1/20 0.34
HSD17B10 Q99714 1/20 0.33
PDE5A O76074 1/20 0.33
HTR1A P08908 1/20 0.33
HTR7 P34969 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
SCHEMBL4768214 0.96 MTOR (0.36) MTORPIK3CAMAPTKMT2AMALT1
SCHEMBL4763586 0.89 SYK (0.34) KDM4EALDH1A1HPGDMAPTKMT2A
Hydrochloric Acid SCHEMBL4773685 0.88 SYK (0.34) KDM4EALDH1A1HPGDACHESYK
Oxalic Acid SCHEMBL6289166 0.87 SYK (0.35) ALDH1A1HPGDKMT2ASYKHTR1A
Oxalic Acid SCHEMBL4773270 0.85 KDM4E (0.35) KDM4EALDH1A1HPGDMAPTKMT2A
SCHEMBL4769957 0.83 SYK (0.35) HPGDKMT2ASYKHTR1A
Oxalic Acid SCHEMBL6729251 0.81 MTOR (0.33) MTORPIK3CAMAPTMALT1NEK2
SCHEMBL4766680 0.81 ACHE (0.35) KDM4EALDH1A1HPGDMAPTKMT2A
SCHEMBL4765464 0.81 SYK (0.39) HPGDKMT2ASYK
SCHEMBL4772039 0.80 MTOR (0.43) MTORPIK3CAKDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1020445-B1 FUSED PYRIDINE DERIVATIVES EISAI R&D MAN CO LTD (JP) 2008-08-13 EP disclosed
US-6875761-B2 Certain 1,3-disubstituted isoquinoline derivatives EISAI CO., LTD. (JP) 2005-04-05 US disclosed
US-6790844-B2 MUSCLE RELAXANTS; ANTISEROTONINE AGENT EISAI CO., LTD (JP) 2004-09-14 US disclosed
US-20020013460-A1 Condensed pyridine compound EISAI CO., LTD 2002-01-31 US disclosed
US-6340759-B1 ANTISPASMODIC AGENTS EISAI CO., LTD. (JP) 2002-01-22 US disclosed
EP-1020445-A1 FUSED PYRIDINE DERIVATIVES Eisai Co., Ltd. (JP) 2000-07-19 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-20020013460-A1 Condensed pyridine compound MUSK, HTR1A, PAX3 MTOR 1040/4885PIK3CA 2853/4885KDM4E 1050/4885

“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.