SCHEMBL25834664

SCHEMBL25834664

CCC1OC(CO)C(COCC2OC(CO)C(O)C(O)C2O)C(O)C1O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.39
LGALS1 P09382 2/20 0.37
LGALS3 P17931 2/20 0.37
LGALS9 O00182 1/20 0.37
LGALS8 O00214 1/20 0.37
PYGB P11216 3/20 0.36
GAA P10253 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 1/20 0.35
SLC6A2 P23975 1/20 0.33
FBP1 P09467 1/20 0.33
SLC5A2 P31639 1/20 0.32

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
SCHEMBL21554948 0.94 CA2 (0.36) CA2LGALS1LGALS3LGALS9LGALS8
SCHEMBL125944 0.92 CA2 (0.37) CA2LGALS1LGALS3LGALS9LGALS8
SCHEMBL15281520 0.92 CA2 (0.37) CA2LGALS1LGALS3LGALS9LGALS8
SCHEMBL15462243 0.92 CA2 (0.37) CA2LGALS1LGALS3LGALS9LGALS8
SCHEMBL15280935 0.92 CA2 (0.37) CA2LGALS1LGALS3LGALS9LGALS8
SCHEMBL9973538 0.92 CA2 (0.43) CA2LGALS1LGALS3LGALS9LGALS8
SCHEMBL12295132 0.92 LGALS1 (0.42) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL12909288 0.92 LGALS1 (0.42) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL16675113 0.91 CA2 (0.35) CA2PYGBSLC6A2FBP1
SCHEMBL14338482 0.91 CA2 (0.35) CA2PYGBSLC6A2FBP1

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-20230227936-A1 EXTRACTING BASE METALS USING A WETTING AGENT AND A THIOCARBONYL FUNCTIONAL GROUP REAGENT JETTI RESOURCES, LLC (US) 2023-07-20 US disclosed