SCHEMBL7471435

SCHEMBL7471435

Cn1cccc1-c1nc(/C=[N+](\[O-])C(C)(C)C)c[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
KDM4E B2RXH2 3/20 0.38
RECQL P46063 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 3/20 0.33
GAA P10253 1/20 0.33
CYP2A6 P11509 1/20 0.33
CYP2A13 Q16696 1/20 0.33
MAPT P10636 2/20 0.32
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.30
ALOX12 P18054 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL7465381 0.77 MEN1 (0.33) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL15330068 0.76 KDM4E (0.44) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL7479201 0.73 NISCH (0.35) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL7474017 0.73 PKN1 (0.32) NPC1RAB9AKDM4ENPSR1ALDH1A1
SCHEMBL7472593 0.73 RAB9A (0.38) KMT2ANPC1RAB9AKDM4ENPSR1
SCHEMBL7475246 0.73 METAP2 (0.37) KMT2ANPC1RAB9AKDM4ENPSR1
SCHEMBL27481619 0.73 ALDH1A1 (0.39) MEN1KMT2AKDM4ERECQLALDH1A1
SCHEMBL7476978 0.73 ALDH1A1 (0.39) MEN1KMT2AKDM4ERECQLALDH1A1
SCHEMBL7467570 0.73 ALDH1A1 (0.36) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL7472583 0.72 TNKS (0.32) MEN1KMT2ANPC1RAB9AKDM4E

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