SCHEMBL9613593

SCHEMBL9613593

COC(=O)C1CC(C)C(OC2OC(C)C(O)C(O)C2O)C(OC2OC(CO)C(O)C(O[C@@H](CC3CCCCC3)C(=O)OO)C2OC(=O)c2ccccc2)C1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SELE P16581 16/20 0.66
▸ SELP P16109 5/20 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
SCHEMBL11962140 0.96 SELE (0.68) SELESELP
SCHEMBL11982132 0.94 SELE (0.70) SELESELP
SCHEMBL12257332 0.92 SELE (0.65) SELESELP
SCHEMBL14823289 0.90 SELE (0.65) SELESELP
SCHEMBL11962141 0.90 SELE (0.67) SELESELP
SCHEMBL14217735 0.90 SELE (0.74) SELESELP
SCHEMBL9613573 0.88 SELE (0.64) SELESELP
SCHEMBL16378227 0.88 SELE (0.67) SELESELP
SCHEMBL16369311 0.88 SELE (0.67) SELESELP
SCHEMBL11962135 0.88 SELE (0.61) SELESELP

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
EP-2457573-A1 Methods of use of glycomimetics with replacements for hexoses and N-Acetyl hexosamines GlycoMimetics, Inc. (US) 2012-05-30 — — EP disclosed
WO-2008060378-A2 GLYCOMIMETIC REPLACEMENTS FOR HEXOSES AND N-ACETYL HEXOSAMINES GLYCOMIMETICS, INC. (US) 2008-05-22 — — WO disclosed
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