Oxalic Acid

Oxalic Acid

SCHEMBL5637574

O=C(NCCCN1CCCC1)Nc1ccc(-c2nnc(CCCCOc3ccccc3)o2)cc1.O=C(O)C(=O)O

nearest known ligand 0.53

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 11)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 3/20 0.53
MAPT P10636 1/20 0.52
KCNH2 Q12809 9/20 0.51
CHRNA7 P36544 8/20 0.51
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HRH3 Q9Y5N1 4/20 0.48
HRH4 Q9H3N8 2/20 0.48
HRH1 P35367 1/20 0.48
ACHE P22303 1/20 0.47

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
SCHEMBL5639226 0.98 HTR3A (0.55) HTR3AMAPTKCNH2CHRNA7HRH3
SCHEMBL5637532 0.88 HTR3A (0.52) HTR3AMAPTKCNH2CHRNA7ACHE
Oxalic Acid SCHEMBL5638226 0.85 MEN1 (0.48) HTR3AMAPTKCNH2CHRNA7KDM4E
SCHEMBL5638548 0.83 MEN1 (0.50) HTR3AMAPTKCNH2CHRNA7HRH3
SCHEMBL5639258 0.82 MEN1 (0.52) HTR3AMAPTKCNH2CHRNA7HRH3
SCHEMBL5637577 0.82 ACHE (0.45) KCNH2CHRNA7KDM4EALDH1A1SMN1; SMN2
Oxalic Acid SCHEMBL5637724 0.78 HTR3A (0.50) HTR3AMAPTKCNH2CHRNA7KDM4E
SCHEMBL5637839 0.76 KCNH2 (0.49) KCNH2CHRNA7KDM4EALDH1A1SMN1; SMN2
SCHEMBL5638832 0.76 HTR3A (0.52) HTR3AMAPTKCNH2CHRNA7HRH3
SCHEMBL5637698 0.74 KCNH2 (0.50) KCNH2CHRNA7KDM4EALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7229987-B2 Multicyclic compounds for use as melanin concentrating hormone antagonists in the treatment of obesity and diabetes ELI LILLY AND COMPANY (US) 2007-06-12 US disclosed
US-20050272718-A1 Multicyclic compounds for use as melanin concentrating hormone antagonists in the treatment of obesity and diabetes AMMENN ET AL, JOCHEN 2005-12-08 US disclosed
EP-1505968-A1 MULTICYCLIC COMPOUNDS FOR USE AS MELANIN CONCENTRATING HORMONE ANTAGONISTS IN THE TREATMENT OF OBESITY AND DIABETES ELI LILLY AND COMPANY (US) 2005-02-16 EP disclosed
WO-2003097047-A1 MULTICYCLIC COMPOUNDS FOR USE AS MELANIN CONCENTRATING HORMONE ANTAGONISTS IN THE TREATMENT OF OBESITY AND DIABETES ELI LILLY AND COMPANY (US) 2003-11-27 WO 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-20050272718-A1 Multicyclic compounds for use as melanin concentrating hormone antagonists in the treatment of obesity and diabetes MC1R, MC4R, MC5R HTR3A 170/4885MAPT 2221/4885KCNH2 3199/4885

“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.