SCHEMBL8472017

SCHEMBL8472017

CCc1cccnc1CCOC1SC(=O)N(Cc2ccccc2)C1=O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.45
MAPT P10636 7/20 0.42
THRB P10828 2/20 0.42
GAA P10253 2/20 0.42
ALDH1A1 P00352 3/20 0.37
TP53 P04637 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PDE4A P27815 2/20 0.35
PDE4B Q07343 2/20 0.35
PDE4C Q08493 2/20 0.35
PDE4D Q08499 2/20 0.35
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
HSP90AA1 P07900 1/20 0.33
KAT2B Q92831 1/20 0.33

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
SCHEMBL8472109 0.81 MAPT (0.42) POLBMAPTTHRBGAAALDH1A1
SCHEMBL8421439 0.79 PPARG (0.43) POLBMAPTTHRBGAAALDH1A1
SCHEMBL8471742 0.79 MAPT (0.41) POLBMAPTTHRBGAAALDH1A1
Hydrochloric Acid SCHEMBL8505855 0.78 PPARG (0.44) POLBMAPTTHRBGAAALDH1A1
SCHEMBL8472016 0.78 PDE4A (0.36) GAAALDH1A1MEN1KMT2APDE4A
SCHEMBL9545693 0.77 MAPT (0.42) POLBMAPTTHRBGAAALDH1A1
SCHEMBL6032173 0.77 MAPT (0.54) POLBMAPTTHRBGAAALDH1A1
SCHEMBL8659796 0.76 MAPT (0.43) POLBMAPTTHRBGAAALDH1A1
SCHEMBL8333731 0.75 PPARG (0.46) POLBMAPTTHRBGAAALDH1A1
SCHEMBL3774754 0.75 MAPT (0.50) POLBMAPTTHRBGAAALDH1A1

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-5952356-A TREATING DIABETES IN A MAMMAL WITH AN ACTIVE MATERIAL AND A GLUCOSIDASE INHIBITOR TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-09-14 US disclosed