SCHEMBL6325507

SCHEMBL6325507

CC(C)(C)c1cc(-n2nc3ccc(Cl)cc3n2)c(-c2ccccc2O)c(C(C)(C)C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.35
RAB9A P51151 4/20 0.35
LMNA P02545 2/20 0.34
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
NR2F2 P24468 1/20 0.32
MAOA P21397 1/20 0.32
KDM4E B2RXH2 2/20 0.32
MAPT P10636 2/20 0.32
ATM Q13315 1/20 0.32
CASR P41180 1/20 0.32
TRPV1 Q8NER1 1/20 0.31
P2RX1 P51575 1/20 0.31
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
ALOX5 P09917 1/20 0.31
PTGS2 P35354 1/20 0.31
ALDH1A1 P00352 2/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL7557353 0.90 NPC1 (0.43) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL11668139 0.83 NPC1 (0.43) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL28057737 0.82 MAPT (0.34) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL6325510 0.81 NPC1 (0.38) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL29241 0.81 NPC1 (0.41) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL29349567 0.81 NPC1 (0.41) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL22372500 0.80 NPC1 (0.44) NPC1RAB9ALMNAMEN1KMT2A
Toluene SCHEMBL29114789 0.79 NPC1 (0.46) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL13567307 0.79 NPC1 (0.36) NPC1RAB9AMEN1KMT2AKDM4E
Bumetrizole SCHEMBL8250511 0.78 NPC1 (0.54) NPC1RAB9ALMNAKDM4EMAPT

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
US-20050191476-A1 Epoxy resin composition excellent in weather resistance and fiber-reinforced composite materials TORAY INDUSTRIES, INC. A CORPORATION OF JAPAN (JP) 2005-09-01 US disclosed
EP-1454956-A1 EPOXY RESIN COMPOSITION EXCELLENT IN WEATHER RESISTANCE AND FIBER-REINFORCED COMPOSITE MATERIALS TORAY INDUSTRIES, INC. (JP) 2004-09-08 EP disclosed