SCHEMBL6048087

SCHEMBL6048087

O=C(O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1S)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 7/20 0.63
LGALS9 O00182 6/20 0.63
LGALS1 P09382 6/20 0.63
LGALS7; LGALS7B P47929 5/20 0.63
LGALS8 O00214 3/20 0.48
MAOB P27338 1/20 0.46
LGALS4 P56470 1/20 0.41
SELP P16109 2/20 0.41
HK1 P19367 2/20 0.41
HK2 P52789 2/20 0.41
PTPN1 P18031 1/20 0.40

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
SCHEMBL7752692 1.00 LGALS3 (0.63) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL15177428 0.92 LGALS3 (0.67) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL16230369 0.86 LGALS9 (0.55) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL30649267 0.86 LGALS3 (0.66) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL30649293 0.86 LGALS3 (0.66) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL8762532 0.86 LGALS3 (0.66) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL15531572 0.86 LGALS3 (0.66) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL9009735 0.86 LGALS3 (0.66) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL11380069 0.86 LGALS3 (0.66) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL8720631 0.84 LGALS3 (0.63) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8

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
WO-2006055437-A2 SYNTHESIS AND USE OF GLYCODENDRIMER REAGENTS GENENCOR INTERNATIONAL, INC. (US) 2006-05-26 WO disclosed