SCHEMBL7322946

SCHEMBL7322946

O=[N+]([O-])c1cccc(Cl)c1NCc1ccccc1Cl

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.71
MAPK1 P28482 2/20 0.71
L3MBTL1 Q9Y468 2/20 0.71
SMN1; SMN2 Q16637 2/20 0.58
NPC1 O15118 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2D6 P10635 1/20 0.58
CYP2C19 P33261 1/20 0.58
RAB9A P51151 1/20 0.58
ALDH1A1 P00352 6/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
PKM P14618 1/20 0.55
PLA2G1B P04054 1/20 0.51
ATG4B Q9Y4P1 1/20 0.51
PRKCQ Q04759 3/20 0.50
GAA P10253 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
TSHR P16473 1/20 0.47

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
SCHEMBL9422864 0.85 MAPT (0.62) MAPTMAPK1L3MBTL1SMN1; SMN2NPC1
SCHEMBL7328985 0.83 MAPT (1.00) MAPTMAPK1L3MBTL1SMN1; SMN2NPC1
SCHEMBL9422874 0.80 MAPT (0.56) MAPTMAPK1L3MBTL1SMN1; SMN2NPC1
SCHEMBL308233 0.77 MAPT (0.60) MAPTMAPK1L3MBTL1SMN1; SMN2NPC1
SCHEMBL29566643 0.77 MAPT (0.60) MAPTMAPK1L3MBTL1SMN1; SMN2NPC1
SCHEMBL3631214 0.77 MAPT (0.60) MAPTMAPK1L3MBTL1CYP2C19ALDH1A1
SCHEMBL3046272 0.76 MAPT (0.55) MAPTMAPK1L3MBTL1SMN1; SMN2NPC1
SCHEMBL16787440 0.76 MAPT (0.55) MAPTMAPK1L3MBTL1SMN1; SMN2NPC1
SCHEMBL9422998 0.75 MAPT (0.57) MAPTMAPK1L3MBTL1SMN1; SMN2NPC1
SCHEMBL9422830 0.75 MAPT (0.63) MAPTMAPK1L3MBTL1SMN1; SMN2NPC1

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-5075304-A Nervous system disorders NOVO NORDISK A/S (DK) 1991-12-24 US disclosed
EP-0344943-A1 Imidazoquinoxaline compounds and their preparation and use NOVO NORDISK A/S (DK) 1989-12-06 EP disclosed