SCHEMBL9070867

SCHEMBL9070867

Cc1csc(NC(=O)c2cc(OCc3ccccc3)nc(OC(C)C)c2)n1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCD O00767 4/20 0.56
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
GCK P35557 8/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
MAPT P10636 2/20 0.50
MAPK1 P28482 1/20 0.50
HPGD P15428 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HTT P42858 2/20 0.47
GRM5 P41594 1/20 0.47

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
SCHEMBL9070864 0.90 NPC1 (0.54) SCDNPC1RAB9AGCKMEN1
SCHEMBL9070919 0.90 GRM5 (0.55) SCDNPC1RAB9AGCKMEN1
SCHEMBL2667627 0.89 NPC1 (0.57) SCDNPC1RAB9AGCKMEN1
SCHEMBL2667628 0.89 NPC1 (0.57) SCDNPC1RAB9AGCKMEN1
SCHEMBL2667658 0.89 NPC1 (0.57) SCDNPC1RAB9AGCKMEN1
SCHEMBL2667637 0.89 SCD (0.52) SCDNPC1RAB9AGCKMEN1
SCHEMBL2667671 0.88 GRM5 (0.48) SCDNPC1RAB9AGCKMEN1
SCHEMBL2667619 0.88 NPC1 (0.51) SCDNPC1RAB9AGCKMEN1
SCHEMBL2667598 0.85 NPC1 (0.53) SCDNPC1RAB9AGCKMEN1
SCHEMBL9070866 0.84 KDM4E (0.47) SCDRAB9AGCKMEN1KMT2A

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