SCHEMBL15535406

SCHEMBL15535406

CCCCCCCCCCCCn1cc[n+](C)c1.CCCCCCCCCCn1cc[n+](C)c1

nearest known ligand 0.96

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.96
HSP90AA1 P07900 2/20 0.96
KMT2A Q03164 2/20 0.96
SMN1; SMN2 Q16637 2/20 0.96
APAF1 O14727 1/20 0.96
NPC1 O15118 1/20 0.96
PLA2G1B P04054 1/20 0.96
MAPT P10636 1/20 0.96
MAPK1 P28482 1/20 0.96
HTT P42858 1/20 0.96
RAB9A P51151 1/20 0.96
NPSR1 Q6W5P4 1/20 0.96
ATG4B Q9Y4P1 1/20 0.96
FDPS P14324 16/20 0.44
TBXAS1 P24557 1/20 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
SCHEMBL372300 1.00 MEN1 (0.96) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL34918 1.00 MEN1 (0.96) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL92681 1.00 MEN1 (0.96) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL4061743 1.00 MEN1 (0.96) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL2219975 1.00 MEN1 (0.96) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL413428 1.00 MEN1 (0.96) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL4066192 1.00 MEN1 (0.96) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL2890408 1.00 MEN1 (0.96) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL899203 1.00 MEN1 (0.96) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL5305358 1.00 MEN1 (0.96) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2854749-A2 ANIONIC DYE OR BRIGHTENER BEARING AN AMMONIUM OR PHOSPHONIUM COUNTERION, DYE COMPOSITION COMPRISING THEM AND PROCESS FOR DYEING KERATIN FIBRES USING THESE DYES L'Oréal (FR) 2015-04-08 EP claimed
WO-2013175002-A2 ANIONIC DYE OR BRIGHTENER BEARING AN AMMONIUM OR PHOSPHONIUM COUNTERION, DYE COMPOSITION COMPRISING THEM AND PROCESS FOR DYEING KERATIN FIBRES USING THESE DYES L'OREAL (FR) 2013-11-28 WO claimed
WO-2015078903-A1 COSMETIC PROCESS FOR LIGHTENING THE SKIN WITH AN ANIONIC OPTICAL BRIGHTENER L'OREAL (FR) 2015-06-04 WO disclosed
EP-2854749-A2 ANIONIC DYE OR BRIGHTENER BEARING AN AMMONIUM OR PHOSPHONIUM COUNTERION, DYE COMPOSITION COMPRISING THEM AND PROCESS FOR DYEING KERATIN FIBRES USING THESE DYES L'Oréal (FR) 2015-04-08 EP disclosed
WO-2013175002-A2 ANIONIC DYE OR BRIGHTENER BEARING AN AMMONIUM OR PHOSPHONIUM COUNTERION, DYE COMPOSITION COMPRISING THEM AND PROCESS FOR DYEING KERATIN FIBRES USING THESE DYES L'OREAL (FR) 2013-11-28 WO disclosed