SCHEMBL2920802

SCHEMBL2920802

CN(/N=C/c1cc[n+](CCCCC[n+]2ccc(/C=N/N(C)c3ccccc3)cc2)cc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 10/20 0.47
KMT2A Q03164 10/20 0.47
MAPT P10636 9/20 0.47
SMN1; SMN2 Q16637 6/20 0.47
MAPK1 P28482 2/20 0.47
HSP90AA1 P07900 2/20 0.47
APAF1 O14727 1/20 0.47
HTT P42858 1/20 0.47
BLM P54132 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
CHKA P35790 2/20 0.45
HPGD P15428 1/20 0.45
KDM4A O75164 2/20 0.44
KDM2A Q9Y2K7 2/20 0.44
ALDH1A1 P00352 4/20 0.44
TDP1 Q9NUW8 3/20 0.44
ALOX12 P18054 2/20 0.44
LMNA P02545 2/20 0.44

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
SCHEMBL3024008 1.00 MEN1 (0.47) MEN1KMT2AMAPTSMN1; SMN2MAPK1
SCHEMBL2920805 1.00 MEN1 (0.47) MEN1KMT2AMAPTSMN1; SMN2MAPK1
SCHEMBL3024010 1.00 MEN1 (0.47) MEN1KMT2AMAPTSMN1; SMN2MAPK1
Bromide SCHEMBL2917838 0.98 MAPT (0.49) MEN1KMT2AMAPTSMN1; SMN2MAPK1
Bromide SCHEMBL2916602 0.98 MAPT (0.49) MEN1KMT2AMAPTSMN1; SMN2MAPK1
Bromide SCHEMBL2923043 0.98 MAPT (0.49) MEN1KMT2AMAPTSMN1; SMN2MAPK1
Bromide SCHEMBL2923046 0.98 MAPT (0.49) MEN1KMT2AMAPTSMN1; SMN2MAPK1
SCHEMBL2920143 0.98 MEN1 (0.46) MEN1KMT2AMAPTSMN1; SMN2MAPK1
SCHEMBL2920142 0.98 MEN1 (0.46) MEN1KMT2AMAPTSMN1; SMN2MAPK1
Bromide SCHEMBL2923013 0.97 MAPT (0.47) MEN1KMT2AMAPTSMN1; SMN2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1647548-A1 Dictionic bishydrazones, dyeingcompositions containig at least one of these compounds, process of their preparation and uses thereoff L'OREAL S.A. (FR) 2006-04-19 EP claimed
EP-1647548-B1 Dictionic bishydrazones, dyeingcompositions containig at least one of these compounds, process of their preparation and uses thereoff OREAL (FR) 2010-08-25 EP disclosed
US-7410506-B2 Dicationic bis-hydrazone compound, dye composition comprising at least one such compound, implementation process therefor and uses thereof L'OREAL S.A. (FR) 2008-08-12 US disclosed
EP-1647548-A1 Dictionic bishydrazones, dyeingcompositions containig at least one of these compounds, process of their preparation and uses thereoff L'OREAL S.A. (FR) 2006-04-19 EP disclosed