SCHEMBL20393237

SCHEMBL20393237

CN[C@@H]1C(O)[C@H](O)[C@@H](CO)O[C@H]1O[C@H]1C(O)[C@@H](NC(C)=O)[C@H](O[C@H]2C(O)[C@@H](NC(C)=O)[C@H](O[C@H]3C(O)[C@@H](NC(C)=O)[C@H](O)O[C@H]3CO)O[C@@H]2CO)O[C@H]1CO

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CD69 Q07108 1/20 0.56
▸ LGALS3 P17931 6/20 0.56
▸ LGALS8 O00214 1/20 0.56
▸ LGALS4 P56470 1/20 0.56
▸ CHIA Q9BZP6 1/20 0.55
▸ ALDH1A1 P00352 2/20 0.53
▸ THRB P10828 1/20 0.53
▸ MAPK1 P28482 2/20 0.52
▸ LGALS9 O00182 1/20 0.48
▸ LGALS1 P09382 1/20 0.47
▸ LGALS7; LGALS7B P47929 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ LMNA P02545 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
SCHEMBL20390707 1.00 CD69 (0.56) CD69LGALS3LGALS8LGALS4CHIA
SCHEMBL20390702 1.00 CD69 (0.56) CD69LGALS3LGALS8LGALS4CHIA
SCHEMBL24955828 1.00 CD69 (0.56) CD69LGALS3LGALS8LGALS4CHIA
Triacetylchitotriose SCHEMBL974524 0.95 CD69 (0.60) CD69LGALS3LGALS8LGALS4CHIA
Chitodextrin SCHEMBL21067311 0.95 CD69 (0.60) CD69LGALS3LGALS8LGALS4CHIA
Chitodextrin SCHEMBL19427436 0.95 CD69 (0.60) CD69LGALS3LGALS8LGALS4CHIA
Chitodextrin SCHEMBL13046690 0.95 CD69 (0.60) CD69LGALS3LGALS8LGALS4CHIA
SCHEMBL20390674 0.95 CD69 (0.60) CD69LGALS3LGALS8LGALS4CHIA
Chitodextrin SCHEMBL619918 0.95 CD69 (0.60) CD69LGALS3LGALS8LGALS4CHIA
Chitodextrin SCHEMBL619917 0.95 CD69 (0.60) CD69LGALS3LGALS8LGALS4CHIA

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-20180201549-A1 USE OF FUNGAL STRAINS TO SOLUBILIZE PHOSPHATE AND ENHANCE PLANT GROWTH/YIELD NOVOZYMES BIOAG A/S (DK) 2018-07-19 — — US disclosed
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