SCHEMBL2667799

SCHEMBL2667799

CCOC(=O)Cc1csc(NC(=O)c2cc(Oc3cc(F)cc(F)c3)nc(O[C@H](C)COC)c2)n1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.55
HTT P42858 1/20 0.55
LMNA P02545 2/20 0.52
TSHR P16473 1/20 0.52
GCK P35557 2/20 0.51
ALDH1A1 P00352 3/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
MAPT P10636 6/20 0.49
GAA P10253 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
KCNH2 Q12809 1/20 0.48
CYP1A2 P05177 2/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2C9 P11712 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CYP2C19 P33261 1/20 0.47
NPC1 O15118 1/20 0.47

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
SCHEMBL9070855 0.95 MAPK1 (0.51) MAPK1HTTLMNATSHRGCK
SCHEMBL2667584 0.93 MAPK1 (0.54) MAPK1HTTLMNATSHRGCK
SCHEMBL2667815 0.92 MAPK1 (0.57) MAPK1HTTLMNATSHRGCK
SCHEMBL2667632 0.91 MAPK1 (0.60) MAPK1HTTLMNATSHRALDH1A1
SCHEMBL9071061 0.90 GCK (0.54) MAPK1HTTGCKKCNH2CYP3A4
SCHEMBL9071027 0.90 MAPK1 (0.59) MAPK1HTTLMNATSHRGCK
SCHEMBL2668014 0.88 MAPK1 (0.63) MAPK1HTTLMNATSHRALDH1A1
SCHEMBL2667678 0.88 MAPK1 (0.59) MAPK1HTTLMNATSHRGCK
SCHEMBL2668000 0.87 MAPT (0.63) MAPK1HTTLMNATSHRGCK
SCHEMBL2667825 0.87 GRM5 (0.58) GCKCYP3A4SMN1; SMN2NPC1

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