SCHEMBL5570977

SCHEMBL5570977

CCN(CC[N+](C)(C)C)c1ccc(/N=N/c2nc3c([N+](=O)[O-])cc([N+](=O)[O-])cc3s2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.36
L3MBTL1 Q9Y468 5/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
MAPK1 P28482 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
ALPL P05186 1/20 0.36
ALPI P09923 1/20 0.36
ALPG P10696 1/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
KMT2A Q03164 6/20 0.34
MEN1 O00255 5/20 0.34
ALDH1A1 P00352 4/20 0.34
INSR P06213 3/20 0.34
LMNA P02545 3/20 0.34
KDM4E B2RXH2 2/20 0.34
THRB P10828 2/20 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
SCHEMBL5570983 1.00 MAPT (0.36) MAPTL3MBTL1NPC1RAB9AMAPK1
Bromide SCHEMBL3192822 0.99 MAPT (0.36) MAPTL3MBTL1NPC1RAB9AMAPK1
Bromide SCHEMBL3192825 0.99 MAPT (0.36) MAPTL3MBTL1NPC1RAB9AMAPK1
Bromide SCHEMBL3193685 0.90 MAPT (0.38) MAPTL3MBTL1NPC1RAB9AMAPK1
Bromide SCHEMBL3193680 0.90 MAPT (0.38) MAPTL3MBTL1NPC1RAB9AMAPK1
Bromide SCHEMBL3189317 0.90 INSR (0.35) MAPTL3MBTL1NPC1RAB9AMAPK1
Bromide SCHEMBL3189310 0.90 INSR (0.35) MAPTL3MBTL1NPC1RAB9AMAPK1
Bromide SCHEMBL3196345 0.85 MAPT (0.44) MAPTL3MBTL1NPC1RAB9AMAPK1
Bromide SCHEMBL3196350 0.85 MAPT (0.44) MAPTL3MBTL1NPC1RAB9AMAPK1
Bromide SCHEMBL3185641 0.84 MAPT (0.39) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1820536-A1 Coloring agents for keratin fibers Wella Aktiengesellschaft (DE) 2007-08-22 EP disclosed