SCHEMBL3656211

SCHEMBL3656211

CC(Oc1ccc2nc(NC(=O)O)sc2c1)c1c(F)ccc(F)c1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATAD2 Q6PL18 1/20 0.52
NPC1 O15118 8/20 0.49
RAB9A P51151 8/20 0.49
SMN1; SMN2 Q16637 5/20 0.49
DYRK1A Q13627 3/20 0.49
HTT P42858 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C19 P33261 1/20 0.49
KMT2A Q03164 7/20 0.48
SCD O00767 5/20 0.48
MEN1 O00255 5/20 0.48
MAPT P10636 4/20 0.47
POLB P06746 3/20 0.47
LMNA P02545 2/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
CASP2 P42575 1/20 0.46

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
SCHEMBL3651833 0.94 ATAD2 (0.50) ATAD2NPC1RAB9ASMN1; SMN2DYRK1A
SCHEMBL3656300 0.92 ATAD2 (0.48) ATAD2NPC1RAB9ASMN1; SMN2DYRK1A
SCHEMBL3657485 0.90 NPC1 (0.55) ATAD2NPC1RAB9ASMN1; SMN2DYRK1A
SCHEMBL3657765 0.88 ATAD2 (0.48) ATAD2NPC1RAB9ASMN1; SMN2DYRK1A
SCHEMBL3656715 0.88 ATAD2 (0.48) ATAD2NPC1RAB9ASMN1; SMN2DYRK1A
SCHEMBL3655887 0.86 MET (0.54) ATAD2NPC1RAB9ASMN1; SMN2DYRK1A
SCHEMBL3654365 0.83 ATAD2 (0.54) ATAD2NPC1RAB9ASMN1; SMN2DYRK1A
SCHEMBL3652445 0.82 GHSR (0.55) ATAD2NPC1RAB9ASMN1; SMN2DYRK1A
SCHEMBL3651863 0.81 CSNK1D (0.60) ATAD2NPC1RAB9ASMN1; SMN2DYRK1A
SCHEMBL3655253 0.81 ATAD2 (0.52) ATAD2NPC1RAB9ASMN1; SMN2DYRK1A

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-2205568-A1 6-ARYL/HETEROALKYLOXY BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, APPLICATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS AND NOVEL USE IN PARTICULAR AS C-MET INHIBITORS Sanofi-Aventis (FR) 2010-07-14 EP disclosed
WO-2009087305-A1 6-ARYL/HETEROALKYLOXY BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, APPLICATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS AND NOVEL USE IN PARTICULAR AS C-MET INHIBITORS SANOFI-AVENTIS (FR) 2009-07-16 WO disclosed