SCHEMBL21248544

SCHEMBL21248544

O=C(O)OCC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PYGB P11216 7/20 0.46
▸ LGALS1 P09382 2/20 0.44
▸ LGALS3 P17931 2/20 0.44
▸ LGALS9 O00182 1/20 0.44
▸ LGALS8 O00214 1/20 0.44
▸ FBP1 P09467 1/20 0.42
▸ GAA P10253 2/20 0.42
▸ PRKD3 O94806 1/20 0.40
▸ PRKCG P05129 1/20 0.40
▸ PRKCB P05771 1/20 0.40
▸ PRKCA P17252 1/20 0.40
▸ PRKCH P24723 1/20 0.40
▸ PRKCI P41743 1/20 0.40
▸ PRKCE Q02156 1/20 0.40
▸ PRKCQ Q04759 1/20 0.40
▸ PRKCZ Q05513 1/20 0.40
▸ PRKCD Q05655 1/20 0.40
▸ PRKD1 Q15139 1/20 0.40

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
SCHEMBL25167912 0.86 SLC2A1 (0.41) PYGBFBP1PRKD3PRKCGPRKCB
SCHEMBL11178984 0.82 PYGB (0.45) PYGBLGALS1LGALS3LGALS9LGALS8
SCHEMBL30514366 0.82 PYGB (0.53) PYGBLGALS3GAAPRKD3PRKCG
SCHEMBL17728077 0.79 ALDH1A1 (0.47) PYGBLGALS1LGALS3LGALS9LGALS8
SCHEMBL28677194 0.79 LGALS3 (0.40) PYGBLGALS1LGALS3LGALS9LGALS8
SCHEMBL27988153 0.79 LGALS9 (0.53) LGALS1LGALS3LGALS9
SCHEMBL13063075 0.79 LGALS1 (0.50) PYGBLGALS1LGALS3LGALS9LGALS8
SCHEMBL19941494 0.78 FBP1 (0.37) PYGBFBP1PRKD3PRKCGPRKCB
SCHEMBL1755358 0.78 LGALS3 (0.64) PYGBLGALS1LGALS3LGALS9LGALS8
SCHEMBL7929801 0.78 LGALS3 (0.64) PYGBLGALS1LGALS3LGALS9LGALS8

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-11712435-B2 Mebendazole prodrugs with enhanced solubility and oral bioavailability THE JOHNS HOPKINS UNIVERSITY (US) 2023-08-01 — — US disclosed
US-20210205271-A1 MEBENDAZOLE PRODRUGS WITH ENHANCED SOLUBILITY AND ORAL BIOAVAILABILITY INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY AS CR V.V.I. 2021-07-08 — — US disclosed
EP-3749652-A1 MEBENDAZOLE PRODRUGS WITH ENHANCED SOLUBILITY AND ORAL BIOAVAILABILITY The Johns Hopkins University (US) 2020-12-16 — — EP disclosed
WO-2019157338-A1 MEBENDAZOLE PRODRUGS WITH ENHANCED SOLUBILITY AND ORAL BIOAVAILABILITY THE JOHNS HOPKINS UNIVERSITY (US) 2019-08-15 — — 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 (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-11712435-B2 Mebendazole prodrugs with enhanced solubility and oral bioavailability CYP3A43, CYP3A4, CYP4B1 PYGB 784/4885LGALS1 4647/4885LGALS3 4087/4885
US-20210205271-A1 MEBENDAZOLE PRODRUGS WITH ENHANCED SOLUBILITY AND ORAL BIOAVAILABILITY CYP3A43, CYP3A4, CYP4B1 PYGB 784/4885LGALS1 4647/4885LGALS3 4087/4885

“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.

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