SCHEMBL5571601

SCHEMBL5571601

CC(=Nc1c(C)cc(C(c2ccc(Br)cc2)c2cc(C)c(N=C(C)c3ccccn3)c(C)c2)cc1C)c1ccccn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.45
RAB9A P51151 5/20 0.45
LMNA P02545 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
MAPT P10636 3/20 0.44
KDM4E B2RXH2 2/20 0.44
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
OPRK1 P41145 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
AGTR1 P30556 3/20 0.40
PAX8 Q06710 1/20 0.40
TLR7 Q9NYK1 1/20 0.39
MITF O75030 1/20 0.38
SLC2A1 P11166 1/20 0.36
TOP2A P11388 1/20 0.35

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
SCHEMBL5571374 0.89 KDM4E (0.43) NPC1RAB9ALMNASMN1; SMN2L3MBTL1
SCHEMBL5571421 0.89 KDM4E (0.43) NPC1RAB9ALMNASMN1; SMN2L3MBTL1
SCHEMBL5569884 0.86 NPC1 (0.44) NPC1RAB9ALMNASMN1; SMN2L3MBTL1
SCHEMBL5573236 0.83 RAB9A (0.47) NPC1RAB9ALMNASMN1; SMN2L3MBTL1
SCHEMBL18896034 0.79 KDM4E (0.54) NPC1RAB9ALMNASMN1; SMN2L3MBTL1
SCHEMBL5588882 0.79 KDM4E (0.54) NPC1RAB9ALMNASMN1; SMN2L3MBTL1
SCHEMBL5693499 0.77 KDM4E (0.53) NPC1RAB9ALMNASMN1; SMN2L3MBTL1
SCHEMBL5568543 0.77 KDM4E (0.43) NPC1RAB9ALMNASMN1; SMN2L3MBTL1
SCHEMBL6917834 0.75 KDM4E (0.58) NPC1RAB9ALMNASMN1; SMN2L3MBTL1
SCHEMBL5589082 0.75 KDM4E (0.58) NPC1RAB9ALMNASMN1; SMN2L3MBTL1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1753773-A1 TRANSITION METAL COMPOUNDS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION ExxonMobil Chemical Patents Inc. (US) 2007-02-21 EP claimed
WO-2005118605-A1 TRANSITION METAL COMPOUNDS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2005-12-15 WO claimed
EP-1753773-A1 TRANSITION METAL COMPOUNDS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION ExxonMobil Chemical Patents Inc. (US) 2007-02-21 EP disclosed
WO-2005118605-A1 TRANSITION METAL COMPOUNDS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2005-12-15 WO disclosed