SCHEMBL6947007

SCHEMBL6947007

COc1ccc(CO[C@H]2[C@H](O)[C@@H](CO)O[C@H](OC)[C@@H]2OCc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LGALS8 O00214 3/20 0.53
SLC6A2 P23975 1/20 0.52
SLC5A2 P31639 5/20 0.51
SLC5A1 P13866 4/20 0.51
SSTR5 P35346 2/20 0.47
SSTR1 P30872 1/20 0.47
SSTR2 P30874 1/20 0.47
SSTR4 P31391 1/20 0.47
SSTR3 P32745 1/20 0.47
LGALS3 P17931 3/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
BCHE P06276 1/20 0.44

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
SCHEMBL13380951 1.00 LGALS8 (0.53) LGALS8SLC6A2SLC5A2SLC5A1SSTR5
SCHEMBL7152720 0.93 LGALS8 (0.60) LGALS8SLC6A2SSTR5SSTR1SSTR2
SCHEMBL21706804 0.93 LGALS8 (0.60) LGALS8SLC6A2SSTR5SSTR1SSTR2
SCHEMBL7152294 0.93 LGALS8 (0.60) LGALS8SLC6A2SSTR5SSTR1SSTR2
SCHEMBL3156075 0.93 LGALS8 (0.60) LGALS8SLC6A2SSTR5SSTR1SSTR2
SCHEMBL6951099 0.90 SSTR5 (0.54) LGALS8SSTR5SSTR1SSTR2SSTR4
SCHEMBL7150592 0.89 LGALS8 (0.58) LGALS8SLC6A2SLC5A2SSTR5SSTR1
SCHEMBL3152068 0.89 LGALS8 (0.58) LGALS8SLC6A2SSTR5SSTR1SSTR2
SCHEMBL3660543 0.88 SLC6A2 (0.48) LGALS8SLC6A2SLC5A2SLC5A1SSTR5
SCHEMBL15481400 0.86 SLC6A2 (0.57) LGALS8SLC6A2SLC5A2SLC5A1LGALS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6534481-B1 Antithrombin III binding domain consisting of a concatenation of five monosaccharides supporting a total of two carboxylic acid functions and at least four sulpho groups, said domain being directly bound at the non-reducing end by a thrombin SANOFI-SYNTHELABO (FR) 2003-03-18 US disclosed
US-6528497-B1 Anticoagulant and antithrombotic like heparin; hexadeca saccharides of three distinct sequences: a sulphated penta saccharide sequence DEFGH, a non-sulphated heptasaccharide sequence Z(MN)3 and a sulphated tetrasaccharide sequence VWXY. SANOFI-SYNTHELABO (FR) 2003-03-04 US disclosed
EP-0912613-B1 SYNTHETIC POLYSACCHARIDES, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI SYNTHELABO (FR) 2002-09-25 EP disclosed