SCHEMBL2667947

SCHEMBL2667947

COc1cc(C(=O)Nc2nc3ccccc3s2)cc(OCCc2ccsc2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 2/20 0.56
SENP8 Q96LD8 2/20 0.56
SENP7 Q9BQF6 2/20 0.56
SENP6 Q9GZR1 2/20 0.56
SCD O00767 7/20 0.52
NPC1 O15118 6/20 0.52
RAB9A P51151 5/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
KDM4E B2RXH2 3/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
HTT P42858 2/20 0.52
DHODH Q02127 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.50
TOP1 P11387 2/20 0.48
PKM P14618 1/20 0.47
PAX8 Q06710 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 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
SCHEMBL9070897 0.86 SCD (0.56) SCDNPC1RAB9AMEN1KMT2A
SCHEMBL2667941 0.83 NPC1 (0.57) SCDNPC1RAB9AMEN1KMT2A
SCHEMBL2667946 0.82 SMN1; SMN2 (0.53) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2667643 0.81 RAB9A (0.49) SCDNPC1RAB9AMEN1KMT2A
SCHEMBL2667945 0.81 RAB9A (0.51) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL2667712 0.81 NPC1 (0.53) SCDNPC1RAB9AMEN1KMT2A
SCHEMBL2667940 0.77 GCK (0.68)
SCHEMBL2667713 0.76 NPC1 (0.52) SCDNPC1RAB9AMEN1KMT2A
SCHEMBL2667497 0.75 SCD (0.52) SCDNPC1RAB9AMEN1KMT2A
SCHEMBL9070888 0.75 PIK3CA (0.47) SCDNPC1RAB9AMEN1KMT2A

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