SCHEMBL7473020

SCHEMBL7473020

CN(C)c1ccc(-c2nc(/C=[N+](\[O-])C(C)(C)C)c[nH]2)cc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TCF4 P15884 1/20 0.36
CTNNB1 P35222 1/20 0.36
NOX1 Q9Y5S8 1/20 0.35
AURKA O14965 10/20 0.34
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
GUSB P08236 1/20 0.33
RAB9A P51151 1/20 0.33
KIF11 P52732 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL7479201 0.85 NISCH (0.35) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL7472583 0.84 TNKS (0.32) ALDH1A1MAPTKDM4ENPC1RAB9A
SCHEMBL7471032 0.84 ALPL (0.36) ALDH1A1MAPTKDM4ENPC1RAB9A
SCHEMBL27552770 0.84 ALPL (0.36) ALDH1A1MAPTKDM4ENPC1RAB9A
SCHEMBL7465381 0.83 MEN1 (0.33) ALDH1A1MAPTKDM4ENPC1RAB9A
SCHEMBL7474017 0.82 PKN1 (0.32) ALDH1A1HSD17B10MAPTKDM4ENPC1
SCHEMBL7473052 0.82 KDM4E (0.40) ALDH1A1NOX1AURKAMAPTKDM4E
SCHEMBL7462399 0.82 ALOX5 (0.32)
SCHEMBL7478575 0.82 MAPT (0.40) ALDH1A1MAPTNPC1GUSBRAB9A
SCHEMBL7475233 0.82 GFER (0.38) KDM4ENPC1RAB9AKIF11

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
CN-1153766-C Nitroketone compound, its preparing process and pharmaceutical composition containing same ɪά��ʵ���� 2004-06-16 CN disclosed
EP-0967207-B1 Nitrone derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2002-09-11 EP disclosed
EP-0967207-A1 Nitrone derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1999-12-29 EP disclosed