SCHEMBL2769482

SCHEMBL2769482

CCN(CCn1cc[n+](C)c1)c1ccc(/N=N/c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3s2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.37
L3MBTL1 Q9Y468 4/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
MAPK1 P28482 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
ALPL P05186 1/20 0.37
ALPI P09923 1/20 0.37
ALPG P10696 1/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
INSR P06213 3/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
APP P05067 1/20 0.35
LMNA P02545 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL2769344 1.00 MAPT (0.37) MAPTL3MBTL1NPC1RAB9AMAPK1
Bromide SCHEMBL2770156 0.99 MAPT (0.37) MAPTL3MBTL1NPC1RAB9AMAPK1
Bromide SCHEMBL2771594 0.99 MAPT (0.37) MAPTL3MBTL1NPC1RAB9AMAPK1
SCHEMBL2770268 0.90 MAPT (0.39) MAPTL3MBTL1NPC1RAB9AMAPK1
SCHEMBL2770269 0.90 MAPT (0.39) MAPTL3MBTL1NPC1RAB9AMAPK1
Bromide SCHEMBL2769769 0.89 MAPT (0.39) MAPTL3MBTL1NPC1RAB9AMAPK1
Bromide SCHEMBL2769766 0.89 MAPT (0.39) MAPTL3MBTL1NPC1RAB9AMAPK1
SCHEMBL2786846 0.86 MAPT (0.36) MAPTL3MBTL1NPC1RAB9AMAPK1
SCHEMBL2786849 0.86 MAPT (0.36) MAPTL3MBTL1NPC1RAB9AMAPK1
Bromide SCHEMBL2770872 0.86 MAPT (0.35) MAPTL3MBTL1NPC1RAB9AMAPK1

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-1825883-B1 Agents for coloring keratin fibers PROCTER & GAMBLE (US) 2010-04-14 EP claimed
EP-1825883-A1 Agents for coloring keratin fibers Wella Aktiengesellschaft (DE) 2007-08-29 EP claimed