SCHEMBL11064116

SCHEMBL11064116

N#[N+]c1ccc(Nc2ccccc2)nc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 1/20 0.51
MAPT P10636 4/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
LMNA P02545 1/20 0.49
PDGFRB P09619 3/20 0.43
PDGFRA P16234 3/20 0.43
RAB9A P51151 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALPG P10696 1/20 0.42
GRM5 P41594 1/20 0.41
ALDH1A1 P00352 3/20 0.41
CDK2 P24941 2/20 0.40
MAPK1 P28482 2/20 0.40
NPC1 O15118 2/20 0.40
CHEK1 O14757 1/20 0.40
IKBKB O14920 1/20 0.40
AURKA O14965 1/20 0.40
PDPK1 O15530 1/20 0.40

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
SCHEMBL11061272 0.83 GRM5 (0.44) MAPTMEN1KMT2ALMNARAB9A
SCHEMBL11064014 0.81 PRKAA2 (0.36) HCAR3MAPTMEN1KMT2ALMNA
SCHEMBL11057944 0.81 KMT2A (0.48) MEN1KMT2ALMNARAB9ATDP1
SCHEMBL11061826 0.79 NPC1 (0.55) MAPTMEN1KMT2ALMNAPDGFRB
SCHEMBL11060545 0.75 FABP1 (0.53) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL741543 0.74 ALDH1A1 (0.62) MAPTMEN1KMT2ALMNATDP1
SCHEMBL11062971 0.73 HCAR3 (0.44) HCAR3MAPT
Bromide SCHEMBL8910214 0.72 ALDH1A1 (0.59) MAPTMEN1KMT2ALMNATDP1
Hydrochloric Acid SCHEMBL8911949 0.72 ALDH1A1 (0.59) MAPTMEN1KMT2ALMNATDP1
SCHEMBL21258720 0.72 HCAR3 (0.56) HCAR3MAPTMEN1KMT2ALMNA

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