SCHEMBL1759556

SCHEMBL1759556

CCOC(=O)CCc1c[nH]c2cc(COc3ccc(-c4cc(F)c(F)cc4OC)cc3)ccc12

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GYS1 P13807 19/20 0.47
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 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
SCHEMBL1759563 0.92 GYS1 (0.49) GYS1
SCHEMBL1759705 0.90 GYS1 (0.56) GYS1
SCHEMBL1759696 0.84 GYS1 (0.55) GYS1
SCHEMBL1759662 0.83 GYS1 (0.48) GYS1
SCHEMBL1759586 0.77 GYS1 (0.49) GYS1
SCHEMBL1759588 0.76 GYS1 (0.49) GYS1
SCHEMBL1760262 0.76 GYS1 (0.52) GYS1
SCHEMBL21384325 0.76 MTNR1A (0.61) ALDH1A1MAPT
SCHEMBL1759511 0.75 GYS1 (0.49) GYS1
SCHEMBL1760807 0.74 GYS1 (0.48) GYS1

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
WO-2011057959-A1 INDOLE AND INDAZOLE DERIVATIVES AS GLYCOGEN SYNTHASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2011-05-19 WO disclosed