SCHEMBL9071027

SCHEMBL9071027

CCOC(=O)Cc1csc(NC(=O)c2cc(Oc3ccc(OC)cc3)nc(O[C@H](C)COC)c2)n1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.59
HTT P42858 2/20 0.56
ALDH1A1 P00352 2/20 0.55
TP53 P04637 1/20 0.54
MAPT P10636 8/20 0.54
GAA P10253 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
LMNA P02545 1/20 0.53
TSHR P16473 1/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
PKM P14618 1/20 0.52
GCK P35557 1/20 0.52
KCNH2 Q12809 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL2667584 0.94 MAPK1 (0.54) MAPK1HTTALDH1A1TP53MAPT
SCHEMBL2668000 0.92 MAPT (0.63) MAPK1HTTALDH1A1TP53MAPT
SCHEMBL2667758 0.92 MAPK1 (0.63) MAPK1HTTALDH1A1TP53MAPT
SCHEMBL2667705 0.92 GCK (0.63) MAPK1HTTALDH1A1LMNATSHR
SCHEMBL2667560 0.92 GCK (0.56) MAPK1HTTALDH1A1MAPTGAA
SCHEMBL2667791 0.92 MAPT (0.56) MAPK1HTTALDH1A1TP53MAPT
SCHEMBL2667790 0.92 MAPK1 (0.52) MAPK1HTTALDH1A1TP53MAPT
SCHEMBL9071021 0.91 GCK (0.51) MAPK1ALDH1A1MAPTLMNATSHR
SCHEMBL2667678 0.90 MAPK1 (0.59) MAPK1HTTALDH1A1MAPTGAA
SCHEMBL2667799 0.90 MAPK1 (0.55) MAPK1HTTALDH1A1MAPTGAA

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