SCHEMBL7035249

SCHEMBL7035249

O=C(O)c1cccc(-c2ccccc2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)c1

nearest known ligand 0.74

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SELP P16109 2/20 0.56
SELPLG Q14242 1/20 0.56
TYR P14679 1/20 0.55
NPC1 O15118 1/20 0.54
USP2 O75604 1/20 0.54
TNNI3 P19429 1/20 0.54
TNNT2 P45379 1/20 0.54
RAB9A P51151 1/20 0.54
TNNC1 P63316 1/20 0.54
HKDC1 Q2TB90 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54

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
SCHEMBL23479671 1.00 SELP (0.56) SELPSELPLGTYRNPC1USP2
SCHEMBL23479703 1.00 SELP (0.56) SELPSELPLGTYRNPC1USP2
SCHEMBL7035257 1.00 SELP (0.56) SELPSELPLGTYRNPC1USP2
SCHEMBL23479746 1.00 SELP (0.56) SELPSELPLGTYRNPC1USP2
SCHEMBL7030131 0.88 TYR (0.57) TYR
SCHEMBL7030124 0.88 TYR (0.57) TYR
SCHEMBL23479673 0.88 TYR (0.58) TYR
SCHEMBL7030619 0.88 TYR (0.58) TYR
SCHEMBL7030610 0.88 TYR (0.58) TYR
SCHEMBL23479694 0.88 TYR (0.58) TYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758243-B1 BINDING OF E-SELECTIN, P-SELECTIN OR L-SELECTIN TO SIALYL-LEWISx OR SIALYL-LEWISa TEXAS BIOTECHNOLOGY CORP (US) 2003-03-12 EP disclosed
EP-0758243-A4 BINDING OF E-SELECTIN, P-SELECTIN OR L-SELECTIN TO SIALYL-LEWISx OR SIALYL-LEWISa TEXAS BIOTECHNOLOGY CORP (US) 1997-08-20 EP disclosed
EP-0758243-A1 BINDING OF E-SELECTIN, P-SELECTIN OR L-SELECTIN TO SIALYL-LEWISx OR SIALYL-LEWISa TEXAS BIOTECHNOLOGY CORPORATION (US) 1997-02-19 EP disclosed
WO-1995029682-A1 BINDING OF E-SELECTIN, P-SELECTIN OR L-SELECTIN TO SIALYL-LEWISx OR SIALYL-LEWIS?a¿ TEXAS BIOTECHNOLOGY CORPORATION (US) 1995-11-09 WO disclosed
US-5444050-A Binding of E-selectin or P-selectin to sialyl Lewisx or sialyl-Lewisa TEXAS BIOTECHNOLOGY CORPORATION (US) 1995-08-22 US disclosed