SCHEMBL15470313

SCHEMBL15470313

c1ccc(-c2ccc(-c3ccc4c(c3)Sc3ccccc3N4c3ccc(-c4ccc(-c5cccc6c5sc5ccccc56)cc4)cc3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.44
PRKDC P78527 3/20 0.37
PDE6D O43924 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
BCHE P06276 4/20 0.34
PARP14 Q460N5 1/20 0.33
F9 P00740 1/20 0.32
PIK3CD O00329 1/20 0.31
BRD4 O60885 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
MTOR P42345 1/20 0.31
PIK3CG P48736 1/20 0.31
KCNH2 Q12809 1/20 0.31
BRDT Q58F21 1/20 0.31
LIMK1 P53667 2/20 0.31
SLC6A3 Q01959 1/20 0.31
PIM3 Q86V86 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
SCHEMBL15470312 0.97 ALOX5 (0.47) ALOX5PRKDCPDE6DTNKSTNKS2
SCHEMBL15470306 0.91 ALOX5 (0.49) ALOX5PRKDCPDE6DHDAC6TNKS
SCHEMBL15470321 0.91 ALOX5 (0.45) ALOX5PRKDCPDE6DTNKSTNKS2
SCHEMBL15470314 0.91 ALOX5 (0.42) ALOX5PRKDCPDE6DTNKSTNKS2
SCHEMBL15469990 0.90 ALOX5 (0.40) ALOX5PRKDCBCHE
SCHEMBL15470346 0.86 ALOX5 (0.48) ALOX5PRKDCPDE6DTNKSTNKS2
SCHEMBL15470340 0.86 ALOX5 (0.51) ALOX5PRKDCPDE6DTNKSTNKS2
SCHEMBL15470214 0.85 HDAC6 (0.38) PDE6DHDAC6TNKSTNKS2BCHE
SCHEMBL15470002 0.85 ALOX5 (0.36) ALOX5PRKDCBCHESLC6A3
SCHEMBL15470310 0.84 ALOX5 (0.46) ALOX5PRKDCTNKSTNKS2BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140042412-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT-EMITTING DIODE CHEIL INDUSTRIES, INC. (KR) 2014-02-13 US disclosed
US-20140042412-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT-EMITTING DIODE CHEIL INDUSTRIES, INC. (KR) 2014-02-13 US disclosed