SCHEMBL13594841

SCHEMBL13594841

CC1(C)OC(CO)[C@@H](O)C(O)[C@H]1O

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PYGB P11216 8/20 0.44
PYGL P06737 3/20 0.44
PYGM P11217 2/20 0.44
SLC5A1 P13866 2/20 0.38
SLC5A2 P31639 2/20 0.38

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
SCHEMBL18890762 1.00 PYGB (0.44) PYGBPYGLPYGMSLC5A1SLC5A2
SCHEMBL14502562 1.00 PYGB (0.44) PYGBPYGLPYGMSLC5A1SLC5A2
SCHEMBL19226203 1.00 PYGB (0.44) PYGBPYGLPYGMSLC5A1SLC5A2
SCHEMBL14502563 1.00 PYGB (0.44) PYGBPYGLPYGMSLC5A1SLC5A2
SCHEMBL14502578 1.00 PYGB (0.44) PYGBPYGLPYGMSLC5A1SLC5A2
SCHEMBL24924778 1.00 PYGB (0.44) PYGBPYGLPYGMSLC5A1SLC5A2
SCHEMBL13787598 0.93 PYGB (0.38) PYGBPYGLPYGMSLC5A1SLC5A2
SCHEMBL12929272 0.93 PYGB (0.38) PYGBPYGLPYGMSLC5A1SLC5A2
SCHEMBL12899851 0.93 PYGB (0.38) PYGBPYGLPYGMSLC5A1SLC5A2
SCHEMBL16812689 0.80 PYGB (0.43) PYGBPYGLPYGM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090318675-A1 NOVEL GEM-DIFLUORINATED C-GLYCOSIDE COMPOUNDS DERIVED FROM PODOPHYLLOTOXIN, THEIR PREPARATION AND THEIR APPLICATIONS SUNSHINE BIOPHARMA INC. (CA) 2009-12-24 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-20090318675-A1 NOVEL GEM-DIFLUORINATED C-GLYCOSIDE COMPOUNDS DERIVED FROM PODOPHYLLOTOXIN, THEIR PREPARATION AND THEIR APPLICATIONS GLRA3, GMNN, B3GAT3 PYGB 1099/4885PYGL 1504/4885PYGM 2194/4885

“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.