Oxalic Acid

Oxalic Acid

SCHEMBL6289166

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

nearest known ligand 0.35

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
SYK P43405 4/20 0.35
RXFP1 Q9HBX9 3/20 0.33
CYP2D6 P10635 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CYP2C19 P33261 1/20 0.32
HTR1A P08908 2/20 0.32
HTR2C P28335 2/20 0.32
GBA1 P04062 1/20 0.32
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
PAX8 Q06710 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CHRM1 P11229 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
PDE3B Q13370 1/20 0.32

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
SCHEMBL4769957 0.96 SYK (0.35) SYKRXFP1CYP2D6MEN1KMT2A
Oxalic Acid SCHEMBL4773270 0.88 KDM4E (0.35) SYKRXFP1CYP2D6MEN1KMT2A
Oxalic Acid SCHEMBL4772215 0.87 MTOR (0.36) SYKKMT2AHTR1AHPGDALDH1A1
SCHEMBL4763586 0.84 SYK (0.34) SYKRXFP1CYP2D6MEN1KMT2A
Hydrochloric Acid SCHEMBL4773685 0.83 SYK (0.34) SYKRXFP1HTR1AHPGDPDE4A
SCHEMBL4773666 0.83 CHUK (0.35) SYKRXFP1CYP2D6MEN1KMT2A
SCHEMBL4765464 0.82 SYK (0.39) SYKRXFP1CYP2D6MEN1KMT2A
SCHEMBL4768214 0.82 MTOR (0.36) SYKKMT2AHTR1A
Hydrochloric Acid SCHEMBL4769740 0.82 SYK (0.39) SYKRXFP1MEN1KMT2AHTR2C
SCHEMBL4768231 0.81 SYK (0.39) SYKRXFP1MEN1KMT2APDE4A

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
US-6875761-B2 Certain 1,3-disubstituted isoquinoline derivatives EISAI CO., LTD. (JP) 2005-04-05 US disclosed
US-20040204421-A1 Certain 1,3-disubstituted isoquinoline derivatives EISAI CO., LTD. 2004-10-14 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 (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-20020013460-A1 Condensed pyridine compound MUSK, HTR1A, PAX3 SYK 3149/4885RXFP1 634/4885CYP2D6 3573/4885
US-20040204421-A1 Certain 1,3-disubstituted isoquinoline derivatives MUSK, HTR1A, RYR1 SYK 2669/4885RXFP1 82/4885CYP2D6 2558/4885

“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.