SCHEMBL7475233

SCHEMBL7475233

CC(C)(C)/[N+]([O-])=C/c1c[nH]c(-c2ccc(C(F)(F)F)cc2)n1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.38
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
ATM Q13315 1/20 0.38
TNKS O95271 2/20 0.33
TNKS2 Q9H2K2 2/20 0.33
WNT3A P56704 1/20 0.33
PARP2 Q9UGN5 1/20 0.33
NPBWR1 P48145 1/20 0.33
CXCR2 P25025 1/20 0.33
TYMP P19971 1/20 0.33
SCN2A Q99250 2/20 0.33
KIF11 P52732 1/20 0.33
DGAT1 O75907 1/20 0.32
SOAT1 P35610 1/20 0.32
KCNH2 Q12809 1/20 0.32

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
SCHEMBL7472583 0.86 TNKS (0.32) RAB9AKDM4ENPC1TNKSTNKS2
SCHEMBL7474017 0.85 PKN1 (0.32) RAB9AKDM4ENPC1KIF11
SCHEMBL7479201 0.85 NISCH (0.35) RAB9ANPC1NPBWR1
SCHEMBL7471032 0.84 ALPL (0.36) RAB9AKDM4ENPC1NPBWR1
SCHEMBL27552770 0.84 ALPL (0.36) RAB9AKDM4ENPC1NPBWR1
SCHEMBL7465381 0.83 MEN1 (0.33) RAB9AKDM4ENPC1POLBNPBWR1
SCHEMBL7473020 0.82 ALDH1A1 (0.36) RAB9AKDM4ENPC1KIF11
SCHEMBL7478575 0.82 MAPT (0.40) GFERRAB9ANPC1POLBTNKS
SCHEMBL7473052 0.82 KDM4E (0.40) GFERRAB9AKDM4ENPC1ATM
SCHEMBL7462399 0.82 ALOX5 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0967207-B1 Nitrone derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2002-09-11 EP disclosed
US-6034250-A ANTIOXIDANTS ADIR ET COMPAGNIE (FR) 2000-03-07 US disclosed
EP-0967207-A1 Nitrone derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1999-12-29 EP disclosed