SCHEMBL9070865

SCHEMBL9070865

CC(C)COc1cc(C(=O)Nc2nccs2)cc(OC(C)C)n1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.50
GCK P35557 5/20 0.50
BRD4 O60885 1/20 0.50
MAPT P10636 1/20 0.50
ADORA2A P29274 3/20 0.49
RAB9A P51151 6/20 0.48
NPC1 O15118 5/20 0.48
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
KMT2A Q03164 1/20 0.47
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.46
KCNK3 O14649 1/20 0.46
KCNK9 Q9NPC2 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
KCNH2 Q12809 1/20 0.46

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
SCHEMBL2667680 0.90 SMN1; SMN2 (0.57) SMN1; SMN2GCKBRD4MAPTADORA2A
SCHEMBL2667639 0.88 HTT (0.38) SMN1; SMN2GCKMAPTADORA2ARAB9A
SCHEMBL2667602 0.87 SMN1; SMN2 (0.59) SMN1; SMN2GCKBRD4MAPTADORA2A
SCHEMBL9070879 0.87 GCK (0.62) SMN1; SMN2GCKBRD4MAPTRAB9A
SCHEMBL2667507 0.87 GCK (0.62) SMN1; SMN2GCKBRD4MAPTRAB9A
SCHEMBL2667508 0.87 GCK (0.62) SMN1; SMN2GCKBRD4MAPTRAB9A
SCHEMBL2667721 0.87 GCK (0.56) SMN1; SMN2GCKBRD4MAPTADORA2A
SCHEMBL2667594 0.86 GCK (0.49) SMN1; SMN2GCKBRD4MAPTADORA2A
SCHEMBL2667541 0.85 GCK (0.47) SMN1; SMN2GCKBRD4MAPTADORA2A
SCHEMBL2667598 0.85 NPC1 (0.53) SMN1; SMN2GCKBRD4MAPTRAB9A

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-2009083553-A1 AZINE COMPOUNDS AS GLUCOKINASE ACTIVATORS RHEOSCIENCE A/S (DK) 2009-07-09 WO disclosed