SCHEMBL2658151

SCHEMBL2658151

Cc1cnc(NC(=O)c2cc(OCc3ccccc3)cc(O[C@@]3(C)CCNC3=O)c2)cn1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GCK P35557 13/20 0.52
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
RARA P10276 2/20 0.41
RARB P10826 2/20 0.41
RARG P13631 1/20 0.41
WNT1 P04628 1/20 0.40
DYRK1A Q13627 1/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
KCNH2 Q12809 2/20 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
SCHEMBL2657403 0.85 GCK (0.40) GCKKCNH2
SCHEMBL2657127 0.83 MEN1 (0.59) GCKMEN1KMT2A
SCHEMBL2659053 0.82 LMNA (0.47) GCKMEN1KMT2ARAB9ANPC1
SCHEMBL2656678 0.82 LMNA (0.47) GCKMEN1KMT2ARAB9ANPC1
SCHEMBL2655778 0.80 GCK (0.62) GCKMEN1KMT2ARARARARB
SCHEMBL1427030 0.79 GCK (0.75) GCKRARARARBRARG
SCHEMBL2656839 0.78 GCK (0.55) GCKKCNH2
SCHEMBL2659314 0.77 GCK (0.55) GCKKCNH2
SCHEMBL2657535 0.76 GCK (0.48) GCKRAB9ANPC1KCNH2
SCHEMBL1426977 0.75 GCK (0.66) GCKRARARARBKCNH2

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-2086964-A2 BENZOYL AMINO HETEROCYCLYL COMPOUNDS USEFUL IN THE TREATMENT OF A DISEASE MEDIATED THROUGH GLK Astra Zeneca AB (SE) 2009-08-12 EP disclosed
WO-2008050101-A2 BENZOYL AMINO HETEROCYCLYL COMPOUNDS USEFUL IN THE TREATMENT OF A DISEASE MEDIATED THROUGH GLK ASTRAZENECA AB (SE) 2008-05-02 WO disclosed