SCHEMBL3424099

SCHEMBL3424099

CCN(CC)c1ccc(-c2c3ccccc3[n+](CC)c3ccccc23)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 11/20 0.75
L3MBTL1 Q9Y468 4/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
USP2 O75604 2/20 0.49
POLB P06746 1/20 0.49
BLM P54132 1/20 0.49
NLRP3 Q96P20 1/20 0.49
CNR2 P34972 2/20 0.39
KDM1A O60341 1/20 0.38
BCHE P06276 2/20 0.38
ALDH1A1 P00352 4/20 0.38
MAPK1 P28482 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
PSMD14 O00487 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
RECQL P46063 1/20 0.38

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
SCHEMBL3424278 0.86 ACHE (1.00) ACHEL3MBTL1CNR2KDM1ABCHE
SCHEMBL3425651 0.86 ACHE (0.55) ACHEL3MBTL1MEN1KMT2ANPC1
SCHEMBL3424200 0.85 ACHE (0.56) ACHEL3MBTL1MEN1KMT2ANPC1
SCHEMBL3424300 0.85 ACHE (0.68) ACHEL3MBTL1MEN1KMT2ANPC1
SCHEMBL3423158 0.84 ACHE (0.66) ACHEL3MBTL1MEN1KMT2ANPC1
Bromide SCHEMBL3392109 0.83 ACHE (0.64) ACHEL3MBTL1MEN1KMT2ANPC1
SCHEMBL3427784 0.79 ACHE (0.48) ACHEL3MBTL1MEN1KMT2ANPC1
SCHEMBL3423205 0.79 MEN1 (0.50) ACHEL3MBTL1MEN1KMT2ANPC1
SCHEMBL10983937 0.76 ACHE (0.62) ACHEL3MBTL1MEN1KMT2ANPC1
SCHEMBL3427099 0.76 NPC1 (0.47) ACHEL3MBTL1MEN1KMT2ANPC1

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