SCHEMBL16710487

SCHEMBL16710487

F[Si](F)(F)c1ccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
MAPT P10636 4/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
KDM4E B2RXH2 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ATM Q13315 2/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
TLR9 Q9NR96 1/20 0.42
APP P05067 2/20 0.35
POLB P06746 1/20 0.33
KCNA3 P22001 1/20 0.32
HSP90AA1 P07900 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
SCHEMBL16710468 1.00 ALDH1A1 (0.50) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL12331530 0.81 ALDH1A1 (0.50) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL6537132 0.80 ALDH1A1 (0.54) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL6123843 0.79 ALDH1A1 (0.72) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL12333623 0.79 ALDH1A1 (0.72) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL12386343 0.79 ALDH1A1 (0.72) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL2389596 0.79 ALDH1A1 (0.72) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL17087772 0.79 ALDH1A1 (0.72) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL36869 0.79 ALDH1A1 (0.72) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL13720763 0.79 ALDH1A1 (0.72) ALDH1A1MAPTL3MBTL1TDP1KDM4E

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-20150129849-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2015-05-14 US disclosed