Meglumine

Meglumine

SCHEMBL4456885

CCCCc1ccc(C#Cc2ccc(CN(C(=O)CC(C)(C)C)c3ccc(F)c(C(=O)O)c3)cc2)cc1.CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

TACR1TTRgyrAgyrBparCparE

The experimentally established mechanism targets of Meglumine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.44
PTPRO Q16827 1/20 0.44
LTB4R2 Q9NPC1 13/20 0.41
STAT3 P40763 6/20 0.37

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
SCHEMBL1734796 0.88 PTPN11 (0.55) PTPN11PTPROLTB4R2STAT3
Meglumine SCHEMBL1816154 0.84 PTPN11 (0.48) PTPN11PTPROLTB4R2STAT3
SCHEMBL2861555 0.81 PTPN11 (0.46) PTPN11PTPROLTB4R2STAT3
SCHEMBL13711681 0.81 LTB4R2 (0.54) PTPN11PTPROLTB4R2STAT3
SCHEMBL1734595 0.79 PTPN11 (0.66) PTPN11PTPROLTB4R2STAT3
Meglumine SCHEMBL1813196 0.78 PTPN11 (0.75) PTPN11PTPROLTB4R2STAT3
SCHEMBL2858911 0.77 PTPN11 (0.55) PTPN11PTPROLTB4R2STAT3
SCHEMBL12626836 0.76 PTPN11 (0.63) PTPN11PTPROLTB4R2STAT3
Meglumine SCHEMBL4454874 0.76 STAT3 (0.46) PTPN11PTPROLTB4R2STAT3
SCHEMBL1814431 0.75 PTPN11 (0.55) PTPN11PTPROLTB4R2STAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7589232-B2 Alkynyl aryl carboxamides LABORATORIES SERONO S.A. (CH) 2009-09-15 US disclosed
US-20070105913-A1 Alkynyl aryl carboxamides APPLIED RESEARCH SYSTEMS ARS HOLDINGS N.V. (NL) 2007-05-10 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 (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-20070105913-A1 Alkynyl aryl carboxamides ECHS1, IRS1, HCCS PTPN11 97/4885PTPRO 51/4885LTB4R2 827/4885

“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.