SCHEMBL5065006

SCHEMBL5065006

O=C(Nc1ccc(-c2noc(=O)[nH]2)cn1)c1cccc(OCc2ccccc2)c1OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SGMS2 Q8NHU3 5/20 0.48
GAA P10253 1/20 0.42
GCK P35557 2/20 0.41
CXCR2 P25025 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
LRRK2 Q5S007 2/20 0.38
PLA2G10 O15496 1/20 0.38
PLA2G2A P14555 1/20 0.38
AKR1C3 P42330 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
SCHEMBL1793888 0.81 GCK (0.62) GCKCXCR2MEN1KMT2ANPC1
SCHEMBL2664550 0.77 HCAR3 (0.52) MEN1KMT2ANPC1RAB9A
SCHEMBL5070732 0.75 SGMS2 (0.55) SGMS2GAAGCKCXCR2MEN1
SCHEMBL17796443 0.73 XDH (0.45) RAB9A
SCHEMBL7345966 0.69 GCK (0.72) SGMS2GAAGCKCXCR2MEN1
SCHEMBL2653573 0.68 GCK (0.55) SGMS2GAAGCKCXCR2MEN1
SCHEMBL7348393 0.67 SGMS2 (0.65) SGMS2GAAGCKCXCR2MEN1
SCHEMBL27613370 0.67 SGMS2 (0.65) SGMS2GAAGCKCXCR2MEN1
SCHEMBL22351672 0.66 SGMS2 (0.60) SGMS2GAAMEN1KMT2ATDP1
SCHEMBL30322922 0.66 SGMS2 (1.00) SGMS2GAAMEN1KMT2ATDP1

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
EP-1669068-B1 Compounds effecting Glucokinase ASTRAZENECA AB (SE) 2008-06-11 EP disclosed