SCHEMBL20122239

SCHEMBL20122239

CO[C@@H]1OC(CO)[C@@H](O)C(O[C@@H]2OC(CO)[C@H](O)C(O)C2O)C1NC(C)=O

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 7/20 0.58
▸ LGALS8 O00214 3/20 0.58
▸ LGALS4 P56470 1/20 0.58
▸ LGALS7; LGALS7B P47929 2/20 0.53
▸ LGALS1 P09382 1/20 0.53
▸ CD69 Q07108 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.52
▸ THRB P10828 1/20 0.52
▸ LGALS9 O00182 2/20 0.52
▸ MAPK1 P28482 2/20 0.51
▸ PYGB P11216 1/20 0.46

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
SCHEMBL20121276 1.00 LGALS3 (0.58) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL15333778 1.00 LGALS3 (0.58) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL16407357 0.94 LGALS3 (0.64) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL24495336 0.93 LGALS3 (0.52) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL23057244 0.93 LGALS3 (0.52) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL5357606 0.92 LGALS3 (0.68) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL17681107 0.92 LGALS3 (0.68) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL17678835 0.92 LGALS3 (0.68) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL5357615 0.92 LGALS3 (0.68) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL19976159 0.92 LGALS3 (0.68) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1

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-9963729-B2 Diversification of human milk oligosaccharides (HMOs) or precursors thereof GLYCOM A/S (DK) 2018-05-08 — — US disclosed
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