SCHEMBL23121472

SCHEMBL23121472

COc1ccc(O[C@@H]2O[C@H](CO)[C@@H](OC(=O)c3ccccc3)[C@H](O)[C@H]2OC(=O)c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LGALS9 O00182 4/20 0.51
▸ LGALS1 P09382 4/20 0.51
▸ LGALS3 P17931 4/20 0.51
▸ LGALS7; LGALS7B P47929 4/20 0.51
▸ LGALS8 O00214 4/20 0.49
▸ PTPN1 P18031 1/20 0.46
▸ EPHX2 P34913 1/20 0.46
▸ MAOB P27338 1/20 0.44
▸ SLC5A1 P13866 1/20 0.44
▸ SLC5A2 P31639 1/20 0.44
▸ SELP P16109 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
SCHEMBL17880710 0.89 LGALS3 (0.52) LGALS9LGALS1LGALS3LGALS7; LGALS7BLGALS8
SCHEMBL28351909 0.86 LGALS3 (0.57) LGALS9LGALS1LGALS3LGALS7; LGALS7BLGALS8
SCHEMBL23121475 0.85 LGALS8 (0.50) LGALS8SLC5A1SLC5A2
SCHEMBL15475566 0.85 LGALS3 (0.50) LGALS9LGALS1LGALS3LGALS7; LGALS7BLGALS8
SCHEMBL15483275 0.85 LGALS3 (0.50) LGALS9LGALS1LGALS3LGALS7; LGALS7BLGALS8
SCHEMBL15481391 0.85 LGALS3 (0.50) LGALS9LGALS1LGALS3LGALS7; LGALS7BLGALS8
SCHEMBL15475562 0.85 LGALS3 (0.50) LGALS9LGALS1LGALS3LGALS7; LGALS7BLGALS8
SCHEMBL21045068 0.83 PTPN1 (0.49) LGALS9LGALS1LGALS3LGALS7; LGALS7BLGALS8
SCHEMBL29220895 0.83 LGALS3 (0.47) LGALS9LGALS1LGALS3LGALS7; LGALS7BLGALS8
SCHEMBL17880706 0.83 PTPN1 (0.45) LGALS9LGALS1LGALS3LGALS7; 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-2021054474-A1 REPEATING DISACCHARIDE FOR OLIGOSACCHARIDE SYNTHESIS AND METHOD FOR PRODUCING OLIGOMER THEREOF 国立大学法人鳥取大学 2021-03-25 — — WO disclosed
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