SCHEMBL3424673

SCHEMBL3424673

C=CC[n+]1c2ccccc2c(-c2ccc(N(C)C)cc2)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.47
LMNA P02545 4/20 0.37
HTT P42858 4/20 0.37
RAB9A P51151 4/20 0.37
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 3/20 0.37
POLB P06746 3/20 0.37
KMT2A Q03164 3/20 0.37
NPSR1 Q6W5P4 3/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
RAD52 P43351 2/20 0.37
MAPT P10636 2/20 0.37
RECQL P46063 2/20 0.37
PPARG P37231 2/20 0.37
NCOA2 Q15596 2/20 0.37
NCOA1 Q15788 2/20 0.37
NPC1 O15118 2/20 0.37
NSD2 O96028 2/20 0.37
PKM P14618 2/20 0.37

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
Bromide SCHEMBL3399094 0.99 ACHE (0.46) ACHELMNAHTTRAB9AKDM4E
SCHEMBL3423158 0.86 ACHE (0.66) ACHERAB9AKDM4EALDH1A1MEN1
SCHEMBL3423371 0.85 CNR2 (0.41) ACHELMNAALDH1A1MEN1POLB
Bromide SCHEMBL3392109 0.85 ACHE (0.64) ACHERAB9AKDM4EALDH1A1MEN1
SCHEMBL3425204 0.84 ACHE (0.41) ACHERAB9AMEN1KMT2AL3MBTL1
Hydrochloric Acid SCHEMBL3397163 0.83 ACHE (0.40) ACHERAB9AKDM4EMEN1KMT2A
Bromide SCHEMBL3396190 0.83 ACHE (0.40) ACHERAB9AMEN1KMT2AL3MBTL1
SCHEMBL3425651 0.82 ACHE (0.55) ACHELMNAHTTRAB9AKDM4E
SCHEMBL3426006 0.81 ACHE (0.46) ACHEMEN1KMT2AMAPTSMN1; SMN2
Bromide SCHEMBL3399159 0.80 ACHE (0.45) ACHELMNAHTTMEN1KMT2A

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-2245013-A1 9-Ý4-(AMINO) PHENYL¨ACRIDINIUM SALTS AS CATIONIC DIRECT DYES FOR COLORING KERATINOUS FIBERS Henkel AG & Co. KGaA (DE) 2010-11-03 EP claimed
WO-2009103798-A1 9-[4-(AMINO) PHENYL] ACRIDINIUM SALTS AS CATIONIC DIRECT DYES FOR COLORING KERATINOUS FIBERS HENKEL AG & CO. KGAA (DE) 2009-08-27 WO claimed
EP-2245013-A1 9-Ý4-(AMINO) PHENYL¨ACRIDINIUM SALTS AS CATIONIC DIRECT DYES FOR COLORING KERATINOUS FIBERS Henkel AG & Co. KGaA (DE) 2010-11-03 EP disclosed
WO-2009103798-A1 9-[4-(AMINO) PHENYL] ACRIDINIUM SALTS AS CATIONIC DIRECT DYES FOR COLORING KERATINOUS FIBERS HENKEL AG & CO. KGAA (DE) 2009-08-27 WO disclosed