SCHEMBL3434723

SCHEMBL3434723

OCCN(CCO)c1ccc(-c2c3ccccc3[n+](CCO)c3ccccc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACHE P22303 11/20 0.50
ALDH1A1 P00352 1/20 0.35
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
APP P05067 1/20 0.33
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
HTT P42858 1/20 0.31
MCL1 Q07820 1/20 0.31
INSR P06213 1/20 0.31

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
SCHEMBL3424300 0.87 ACHE (0.68) ACHEALDH1A1MAPTMEN1KMT2A
SCHEMBL3424200 0.87 ACHE (0.56) ACHEMAPTMEN1KMT2AAPP
SCHEMBL3427123 0.86 ACHE (0.45) ACHEALDH1A1MAPTMEN1KMT2A
SCHEMBL3422782 0.84 ACHE (0.71) ACHEMAPTMEN1KMT2AAPP
SCHEMBL3422724 0.84 ACHE (0.48) ACHEALDH1A1MAPTMEN1KMT2A
SCHEMBL3426006 0.84 ACHE (0.46) ACHEMAPTMEN1KMT2A
Bromide SCHEMBL3397501 0.83 ACHE (0.69) ACHEMAPTMEN1KMT2AAPP
Hydrochloric Acid SCHEMBL3396105 0.83 ACHE (0.69) ACHEMAPTAPPGAAPKM
Bromide SCHEMBL3399159 0.83 ACHE (0.45) ACHEMAPTMEN1KMT2AGAA
Acetic Acid SCHEMBL3393948 0.78 ACHE (0.61) ACHEMEN1KMT2A

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