SCHEMBL2653573

SCHEMBL2653573

COC(=O)c1ccc(NC(=O)c2cccc(OCc3ccccc3)c2OC(C)C)nc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GCK P35557 10/20 0.55
SGMS2 Q8NHU3 3/20 0.50
CXCR2 P25025 1/20 0.48
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
GAA P10253 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
RARA P10276 1/20 0.44
RARB P10826 1/20 0.44
CASP3 P42574 1/20 0.43
SENP7 Q9BQF6 1/20 0.43

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
SCHEMBL7348393 0.87 SGMS2 (0.65) GCKSGMS2CXCR2MEN1KMT2A
SCHEMBL2651714 0.79 GCK (0.85) GCKRARARARB
SCHEMBL7345966 0.77 GCK (0.72) GCKSGMS2CXCR2MEN1KMT2A
SCHEMBL2650209 0.75 GCK (0.61) GCKRARARARB
SCHEMBL2652506 0.74 GCK (0.81) GCKCXCR2MEN1KMT2ARARA
SCHEMBL8205171 0.74 SGMS2 (0.76) SGMS2MEN1KMT2AGAANPC1
SCHEMBL5430637 0.74 GCK (0.73) GCKRARARARB
SCHEMBL5070732 0.73 SGMS2 (0.55) GCKSGMS2CXCR2MEN1KMT2A
SCHEMBL22871247 0.73 MEN1 (0.50) MEN1KMT2AGAANPC1RAB9A
SCHEMBL14505828 0.72 GCK (0.60) GCKCXCR2MEN1KMT2ANPC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1697325-A1 BENZOYL AMINO PYRIDYL CARBOXYLIC ACID DERIVATIVES USEFUL AS GLUCOKINASE (GLK) ACTIVATORS AstraZeneca AB (SE) 2006-09-06 EP disclosed
WO-2005056530-A1 BENZOYL AMINO PYRIDYL CARBOXYLIC ACID DERIVATIVES USEFUL AS GLUCOKINASE (GLK) ACTIVATORS ASTRAZENECA AB (SE) 2005-06-23 WO disclosed