SCHEMBL11899208

SCHEMBL11899208

COC(=O)CC[C@H]1CCC[C@@H](O[C@@H]2O[C@H](COC(=O)c3ccccc3)[C@H](OC(=O)c3ccccc3)[C@H](O[C@@H](CC3CCCCC3)C(=O)OCc3ccccc3)[C@H]2OC(=O)c2ccccc2)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SELE P16581 10/20 0.49
SELP P16109 7/20 0.37
FGF2 P09038 1/20 0.36
MDK P21741 1/20 0.36
TNF P01375 1/20 0.32
PTPN1 P18031 1/20 0.32
NT5E P21589 1/20 0.31

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
SCHEMBL11899209 1.00 SELE (0.49) SELESELPFGF2MDKTNF
SCHEMBL14932017 0.92 SELE (0.52) SELESELPFGF2MDKNT5E
SCHEMBL14932018 0.92 SELE (0.52) SELESELPFGF2MDKNT5E
SCHEMBL11898820 0.92 SELE (0.52) SELESELPFGF2MDKNT5E
SCHEMBL2010025 0.92 SELE (0.58) SELESELPFGF2MDKNT5E
SCHEMBL2010024 0.92 SELE (0.58) SELESELPFGF2MDKNT5E
SCHEMBL2009280 0.90 SELE (0.42) SELEPTPN1
SCHEMBL2009282 0.90 SELE (0.42) SELEPTPN1
SCHEMBL11982149 0.89 SELE (0.51) SELESELPFGF2MDK
SCHEMBL11898864 0.88 SELE (0.48) SELESELPFGF2MDKNT5E

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-20120202762-A1 METHODS OF USE OF GLYCOMIMETICS WITH REPLACEMENTS FOR HEXOSES AND N-ACETYL HEXOSAMINES GLYCOMIMETICS, INC. (US) 2012-08-09 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-20120202762-A1 METHODS OF USE OF GLYCOMIMETICS WITH REPLACEMENTS FOR HEXOSES AND N-ACETYL HEXOSAMINES FUT6, ENGASE, FUT5 SELE 158/4885SELP 260/4885FGF2 466/4885

“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.