SCHEMBL3087633

SCHEMBL3087633

C=CC[n+]1ccccc1-c1cccc[n+]1CC=C

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
ACHE P22303 2/20 0.35
BCHE P06276 1/20 0.35
HDAC8 Q9BY41 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
POLB P06746 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL11004432 0.80 KDM4E (0.43) KDM4EACHEBCHEHDAC8SMN1; SMN2
SCHEMBL1055898 0.78 SMN1; SMN2 (0.52) KDM4EACHEBCHEHDAC8MEN1
SCHEMBL11286540 0.78 KDM4E (0.42) KDM4EACHEBCHEHDAC8SMN1; SMN2
SCHEMBL2778719 0.78 KDM4E (0.42) KDM4EACHEBCHEHDAC8MEN1
SCHEMBL11004427 0.78 KDM4E (0.46) KDM4EACHEBCHEHDAC8SMN1; SMN2
SCHEMBL4981749 0.78 KDM4E (0.42) KDM4EACHEBCHEHDAC8SMN1; SMN2
SCHEMBL721593 0.78 HDAC8 (0.50) KDM4EACHEBCHEHDAC8MEN1
SCHEMBL950597 0.78 KDM4E (0.42) KDM4EACHEBCHEHDAC8SMN1; SMN2
SCHEMBL3617515 0.77 KDM4E (0.33) KDM4E
Iodide SCHEMBL9773070 0.77 KDM4E (0.41) KDM4EACHEBCHEHDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100181535-A1 THE PHOTOSTABILITY AND/OR CONTROL OF THE FLUORESCENCE INTENSITY OF FLUORESCENT DYES PICOQUANT GMBH (DE) 2010-07-22 US disclosed