SCHEMBL2667574

SCHEMBL2667574

COC[C@@H](C)Oc1cc(C(=O)Nc2nccs2)cc(Oc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCK P35557 13/20 0.61
KCNH2 Q12809 1/20 0.59
ALDH1A1 P00352 4/20 0.59
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
MAPK1 P28482 1/20 0.51
POLB P06746 1/20 0.49
LMNA P02545 1/20 0.49
KDM4E B2RXH2 1/20 0.49

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
SCHEMBL9070946 0.93 GCK (0.62) GCKKCNH2ALDH1A1
SCHEMBL2667645 0.93 GCK (0.62) GCKKCNH2ALDH1A1
SCHEMBL2667769 0.87 GCK (0.58) GCKKCNH2
SCHEMBL9071011 0.86 ALDH1A1 (0.56) GCKKCNH2ALDH1A1MEN1KMT2A
SCHEMBL2667649 0.86 GCK (0.79) GCKKCNH2
SCHEMBL9070848 0.86 GCK (0.64) GCKKCNH2
SCHEMBL2667547 0.85 GCK (0.67) GCKKCNH2
SCHEMBL2667565 0.84 GCK (0.65) GCKKCNH2
SCHEMBL9071014 0.84 GCK (0.61) GCK
SCHEMBL2667364 0.84 TSHR (0.62) GCKALDH1A1MEN1KMT2AMAPK1

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