SCHEMBL17849186

SCHEMBL17849186

CCO[C@@H]1OC(OC=O)[C@@H](O[C@H]2OC(CO)[C@@H](O[C@@H]3OC(OC=O)[C@@H](O[C@H]4OC(CO)[C@@H](OC)[C@H](O)C4NC(C)=O)[C@H](O)C3O)[C@H](O)C2NC(C)=O)[C@H](O)C1O

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 8/20 0.54
▸ LGALS8 O00214 1/20 0.54
▸ LGALS4 P56470 1/20 0.54
▸ CHIA Q9BZP6 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ LGALS7; LGALS7B P47929 3/20 0.44
▸ LGALS1 P09382 1/20 0.44
▸ LGALS9 O00182 3/20 0.43
▸ CD69 Q07108 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ AMY2A P04746 1/20 0.40
▸ HPSE Q9Y251 2/20 0.39

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
SCHEMBL20175842 0.92 LGALS3 (0.52) LGALS3LGALS8LGALS4CHIAMAPK1
SCHEMBL16641974 0.90 LGALS3 (0.54) LGALS3LGALS8LGALS4CHIAMAPK1
SCHEMBL17849185 0.90 LGALS3 (0.54) LGALS3LGALS8LGALS4CHIAMAPK1
SCHEMBL17849187 0.89 LGALS3 (0.55) LGALS3LGALS8LGALS4CHIAMAPK1
SCHEMBL17849726 0.87 LGALS3 (0.53) LGALS3LGALS8LGALS4CHIAMAPK1
SCHEMBL16996680 0.84 LGALS3 (0.58) LGALS3LGALS8LGALS4CHIAMAPK1
SCHEMBL16641977 0.84 LGALS3 (0.58) LGALS3LGALS8LGALS4CHIAMAPK1
SCHEMBL16999977 0.84 LGALS3 (0.58) LGALS3LGALS8LGALS4CHIAMAPK1
SCHEMBL16996679 0.84 LGALS3 (0.58) LGALS3LGALS8LGALS4CHIAMAPK1
SCHEMBL14160272 0.84 LGALS3 (0.58) LGALS3LGALS8LGALS4CHIAMAPK1

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
US-9370583-B2 Coagulation factor VII polypeptides NOVO NORDISK HEALTHCARE AG (CH) 2016-06-21 — — US disclosed
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