SCHEMBL19975699

SCHEMBL19975699

CC(O)CC1OC(O)C(O)C(O)C1O

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LGALS1 P09382 2/20 0.33
LGALS3 P17931 2/20 0.33
LGALS9 O00182 1/20 0.33
LGALS8 O00214 1/20 0.33
FYN P06241 1/20 0.33
MAOA P21397 1/20 0.33
SLC6A2 P23975 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
SLC6A3 Q01959 1/20 0.33
MAPK1 P28482 1/20 0.32
PYGB P11216 2/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL7109528 0.85 LGALS1 (0.45) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL2489683 0.85 LGALS1 (0.45) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL27170351 0.85 LGALS1 (0.45) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL28106543 0.85 LGALS1 (0.45) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL20610479 0.85 LGALS1 (0.45) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL2493227 0.85 LGALS1 (0.45) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL27170348 0.85 LGALS1 (0.45) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL21095319 0.84 LGALS1 (0.34) LGALS1LGALS3LGALS9LGALS8MAPK1
SCHEMBL21095309 0.84 LGALS1 (0.34) LGALS1LGALS3LGALS9LGALS8MAPK1
SCHEMBL12231786 0.84 LGALS1 (0.34) LGALS1LGALS3LGALS9LGALS8MAPK1

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-9920157-B2 Alkoxysilane-terminated prepolymer based on polyether carbonate polyols, for spray foams COVESTRO DEUTSCHLAND AG (DE) 2018-03-20 US disclosed