SCHEMBL3421170

SCHEMBL3421170

CCN(CC)c1ccc(-c2c3ccccc3[n+](C)c3ccccc23)c(O)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 7/20 0.63
BCHE P06276 3/20 0.48
MAPT P10636 5/20 0.42
ALDH1A1 P00352 4/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 2/20 0.42
GAA P10253 2/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
CYP3A4 P08684 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
HPGD P15428 1/20 0.40
ALOX12 P18054 1/20 0.40
USP2 O75604 1/20 0.39
POLB P06746 1/20 0.39
BLM P54132 1/20 0.39

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 SCHEMBL3427155 0.99 ACHE (0.62) ACHEBCHEMAPTALDH1A1MEN1
SCHEMBL3423205 0.88 MEN1 (0.50) ACHEBCHEMAPTALDH1A1MEN1
SCHEMBL13749274 0.86 ACHE (0.63) ACHEBCHEMEN1KMT2AL3MBTL1
SCHEMBL3424738 0.86 ACHE (0.48) ACHEBCHEALDH1A1MEN1KMT2A
SCHEMBL3423185 0.84 ACHE (0.45) ACHEBCHEMAPTALDH1A1MEN1
SCHEMBL3423276 0.83 ACHE (0.59) ACHEBCHEALDH1A1MEN1KMT2A
SCHEMBL3424740 0.82 ACHE (0.45) ACHEBCHEMAPTALDH1A1MEN1
SCHEMBL3425683 0.82 ACHE (0.43) ACHEBCHEMAPTALDH1A1MEN1
Bromide SCHEMBL3396316 0.82 ACHE (0.58) ACHEBCHEALDH1A1MEN1KMT2A
Bromide SCHEMBL3396247 0.81 ACHE (0.42) ACHEBCHEMAPTALDH1A1MEN1

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-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
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