SCHEMBL5316983

SCHEMBL5316983

Clc1ccc(-c2cnc(Nc3ccc4ncsc4c3)o2)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
VCP P55072 3/20 0.58
SIRT7 Q9NRC8 1/20 0.57
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
KMT2A Q03164 1/20 0.46
IKBKB O14920 1/20 0.46
CHUK O15111 1/20 0.46
KDR P35968 8/20 0.45
FLT1 P17948 7/20 0.45
FLT4 P35916 7/20 0.45
IMPDH2 P12268 3/20 0.44
DGAT1 O75907 1/20 0.43
ALOX5 P09917 1/20 0.40
DYRK1A Q13627 1/20 0.39

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
SCHEMBL5318254 0.91 VCP (0.58) VCPSIRT7KDRFLT1FLT4
SCHEMBL14466975 0.88 KDR (0.60) VCPKDRFLT1FLT4IMPDH2
SCHEMBL5316977 0.81 VCP (0.55) VCPSIRT7KDRFLT1FLT4
SCHEMBL5319793 0.78 IMPDH2 (0.60) VCPKDRFLT1FLT4IMPDH2
SCHEMBL5319635 0.78 VCP (0.52) VCPSIRT7MEN1NPC1RAB9A
SCHEMBL5316767 0.77 VCP (0.60) VCPSIRT7KDRFLT1FLT4
SCHEMBL5316742 0.76 SIRT7 (0.60) VCPSIRT7NPC1RAB9AKDR
SCHEMBL5319609 0.76 VCP (0.55) VCPSIRT7KDRFLT1FLT4
SCHEMBL5318214 0.75 PIK3CG (0.62) VCPSIRT7NPC1RAB9ADYRK1A
SCHEMBL15121062 0.74 KDR (0.47) VCPSIRT7MEN1NPC1RAB9A

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
WO-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO claimed
WO-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO disclosed