SCHEMBL21851348

SCHEMBL21851348

CC(=O)NC1C(OC2C(O)C(CO)OC(OC3C(CO)OC(OCCCN)C(O)C3O)C2O)OC(CO)C(O)C1O

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 3/20 0.64
LGALS8 O00214 2/20 0.64
LGALS4 P56470 2/20 0.64
MAPK1 P28482 1/20 0.57
CD69 Q07108 1/20 0.49
IGF2R P11717 2/20 0.47
CHIA Q9BZP6 1/20 0.47
ALDH1A1 P00352 1/20 0.46
THRB P10828 1/20 0.46
CD209 Q9NNX6 2/20 0.44
SIGLEC7 Q9Y286 2/20 0.43
MDK P21741 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HPSE Q9Y251 2/20 0.42

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
SCHEMBL21851468 0.97 LGALS3 (0.68) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL19197194 0.95 LGALS3 (0.68) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL19567579 0.95 LGALS3 (0.68) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL19446174 0.95 MAPK1 (0.62) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL19404728 0.94 LGALS3 (0.64) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL21258434 0.93 LGALS3 (0.74) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL21852877 0.93 LGALS3 (0.74) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL19197226 0.93 LGALS3 (0.74) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL19367491 0.93 LGALS3 (0.74) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL19196654 0.93 LGALS3 (0.74) LGALS3LGALS8LGALS4MAPK1CD69

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-20200109435-A1 DNA-GLYCAN CONJUGATES AND METHODS OF USE GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (GSURF) 2020-04-09 US disclosed