SCHEMBL2667646

SCHEMBL2667646

COC[C@@H](C)Oc1cc(C(=O)NC(=N)S)cc(Oc2ccc(S(=O)(=O)N3CCCC3)cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCK P35557 13/20 0.46
ALDH1A1 P00352 4/20 0.41
POLB P06746 1/20 0.41
KCNH2 Q12809 3/20 0.41
KMT2A Q03164 5/20 0.40
GAA P10253 1/20 0.40
RAB9A P51151 1/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL9070937 0.98 GCK (0.47) GCKALDH1A1POLBKCNH2KMT2A
SCHEMBL9071010 0.93 ALDH1A1 (0.44) GCKALDH1A1POLBKMT2AMEN1
SCHEMBL2667630 0.87 GCK (0.51) GCKKCNH2
SCHEMBL2667970 0.86 GCK (0.51) GCKKCNH2
SCHEMBL9070851 0.85 GCK (0.45) GCKKCNH2
SCHEMBL9071022 0.84 GCK (0.48) GCKKCNH2
SCHEMBL9071057 0.84 GCK (0.53) GCKKCNH2
SCHEMBL2667553 0.83 GCK (0.47) GCKALDH1A1KCNH2KMT2AGAA
SCHEMBL2667727 0.82 ALDH1A1 (0.46) ALDH1A1POLBKMT2AGAARAB9A
SCHEMBL2667582 0.82 L3MBTL1 (0.58) GCKKCNH2

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