SCHEMBL7471032

SCHEMBL7471032

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.36
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
NPBWR1 P48145 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPK1 P28482 1/20 0.33
GCGR P47871 1/20 0.32
DCUN1D1 Q96GG9 1/20 0.32
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 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
SCHEMBL27552770 1.00 ALPL (0.36) ALPLNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL7479201 0.87 NISCH (0.35) NPC1RAB9ASMN1; SMN2MEN1ALDH1A1
SCHEMBL7472583 0.86 TNKS (0.32) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL7465381 0.86 MEN1 (0.33) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL7474017 0.84 PKN1 (0.32) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL27480827 0.84 PKN1 (0.32) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL7472105 0.84 GAA (0.39) KDM4EALDH1A1NPBWR1MGAMGAA
SCHEMBL7473020 0.84 ALDH1A1 (0.36) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL7473052 0.84 KDM4E (0.40) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL7478575 0.84 MAPT (0.40) NPC1RAB9ASMN1; SMN2MEN1ALDH1A1

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
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