SCHEMBL2667653

SCHEMBL2667653

CC(C)Oc1cc(C(=O)Nc2nncs2)cc(OCc2ccccc2F)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCK P35557 2/20 0.49
LMNA P02545 1/20 0.46
KDM4E B2RXH2 1/20 0.44
ECE1 P42892 1/20 0.43
CSNK2A2 P19784 1/20 0.42
CSNK2A1 P68400 1/20 0.42
RARA P10276 1/20 0.42
RARB P10826 1/20 0.42
RARG P13631 1/20 0.42
RAB9A P51151 1/20 0.42
NOX1 Q9Y5S8 1/20 0.42
AQP4 P55087 1/20 0.39
NR3C1 P04150 2/20 0.39
HSD17B13 Q7Z5P4 1/20 0.39
PGR P06401 1/20 0.39
AR P10275 1/20 0.39
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 3/20 0.39
HPGD P15428 2/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL9070866 0.88 KDM4E (0.47) GCKLMNAKDM4ERAB9ANOX1
SCHEMBL2664680 0.86 GCK (0.64) GCKLMNAKDM4EECE1CSNK2A2
SCHEMBL2667681 0.86 GCK (0.50) GCKKDM4ECSNK2A2CSNK2A1RAB9A
SCHEMBL2667619 0.85 NPC1 (0.51) GCKRAB9AHPGD
SCHEMBL2667707 0.84 RAB9A (0.44) GCKLMNAKDM4ERAB9AAQP4
SCHEMBL2667666 0.83 SCD (0.48) GCKLMNAKDM4EALDH1A1
SCHEMBL2667716 0.82 KDM4E (0.48) GCKLMNAKDM4ECSNK2A2CSNK2A1
SCHEMBL2667656 0.81 KDM4E (0.43) LMNAKDM4ERAB9A
SCHEMBL9070891 0.81 NOX1 (0.49) GCKLMNAKDM4ERARARARB
SCHEMBL9070883 0.81 NOX1 (0.49) GCKLMNAKDM4ERARARARB

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