SCHEMBL11057944

SCHEMBL11057944

N#[N+]c1ccc(Nc2ccccn2)nc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
MAPK10 P53779 1/20 0.48
GFER P55789 1/20 0.48
KDR P35968 6/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
ALOX15 P16050 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TP53 P04637 2/20 0.42
TSHR P16473 2/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
ALOX12 P18054 1/20 0.42
HTT P42858 1/20 0.42
KLF5 Q13887 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 2/20 0.40
ADRA2A P08913 2/20 0.39

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
SCHEMBL11064116 0.81 HCAR3 (0.51) KMT2AMEN1NPC1RAB9AALOX15
SCHEMBL26910995 0.77 KMT2A (0.64) KMT2AMEN1MAPK10GFERKDR
SCHEMBL29391624 0.77 KMT2A (0.76) KMT2AMEN1MAPK10GFERKDR
SCHEMBL221242 0.77 KMT2A (0.76) KMT2AMEN1MAPK10GFERKDR
SCHEMBL11133606 0.74 KMT2A (0.73) KMT2AMEN1MAPK10GFERKDR
SCHEMBL4243882 0.74 KMT2A (0.73) KMT2AMEN1MAPK10GFERKDR
SCHEMBL6175579 0.74 KMT2A (0.73) KMT2AMEN1MAPK10GFERKDR
SCHEMBL30947359 0.74 KMT2A (0.73) KMT2AMEN1MAPK10GFERKDR
SCHEMBL6574416 0.74 KMT2A (0.73) KMT2AMEN1MAPK10GFERKDR
Bromide SCHEMBL28368455 0.74 KMT2A (0.73) KMT2AMEN1MAPK10GFERKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4482489-A USEFUL IN DIAZOTYPE SYSTEMS AND AS LATENT POLYMERIZATION INITIATORS JAMES RIVER GRAPHICS, INC. (US) 1984-11-13 US disclosed