SCHEMBL2657794

SCHEMBL2657794

COC(=O)c1cc(Oc2cnc(C(=O)N(C)C)cn2)cc(O[C@@]2(C)CCNC2=O)c1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GCK P35557 16/20 0.46
HPGDS O60760 1/20 0.33
PDE9A O76083 1/20 0.32
OPRM1 P35372 1/20 0.31
OPRL1 P41146 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL2659314 0.86 GCK (0.55) GCK
SCHEMBL1041008 0.77 CA12 (0.44) GCK
SCHEMBL2656839 0.75 GCK (0.55) GCK
SCHEMBL2655275 0.75 GCK (0.43) GCK
SCHEMBL2658396 0.75 CA12 (0.46) HPGDSTSHR
SCHEMBL2656378 0.75 CA12 (0.46) HPGDSTSHR
SCHEMBL1040920 0.73 GCK (0.54) GCK
SCHEMBL2074279 0.73 GCK (0.48) GCKHPGDS
SCHEMBL2657797 0.73 GCK (0.48) GCKHPGDS
SCHEMBL2086782 0.72 GCK (0.65) GCK

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