SCHEMBL15470340

SCHEMBL15470340

c1ccc(-c2ccc(N3c4ccccc4N(c4ccc(-c5cccc6c5sc5ccccc56)cc4)c4ccccc43)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.51
PDE6D O43924 1/20 0.42
PRKDC P78527 5/20 0.41
PARP14 Q460N5 1/20 0.39
TNKS O95271 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
LIMK1 P53667 3/20 0.37
F9 P00740 1/20 0.36
GPR3 P46089 1/20 0.35
MGLL Q99685 2/20 0.35
FAAH O00519 1/20 0.35
PIK3CD O00329 2/20 0.34
PIK3CB P42338 2/20 0.34
BRD4 O60885 1/20 0.34
PIK3CA P42336 1/20 0.34
MTOR P42345 1/20 0.34
PIK3CG P48736 1/20 0.34
KCNH2 Q12809 1/20 0.34
BRDT Q58F21 1/20 0.34
ADK P55263 1/20 0.34

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
SCHEMBL15470346 0.93 ALOX5 (0.48) ALOX5PDE6DPRKDCPARP14TNKS
SCHEMBL15470338 0.88 ALOX5 (0.46) ALOX5PDE6DPRKDCPARP14TNKS
SCHEMBL16884812 0.87 ALOX5 (0.51) ALOX5PDE6DPRKDCPARP14TNKS
SCHEMBL30150735 0.87 ALOX5 (0.64) ALOX5PRKDCPARP14TNKSTNKS2
SCHEMBL17117671 0.87 ALOX5 (0.64) ALOX5PRKDCPARP14TNKSTNKS2
SCHEMBL18435735 0.87 ALOX5 (0.64) ALOX5PRKDCPARP14TNKSTNKS2
SCHEMBL15470306 0.86 ALOX5 (0.49) ALOX5PDE6DPRKDCPARP14TNKS
SCHEMBL15470312 0.86 ALOX5 (0.47) ALOX5PDE6DPRKDCPARP14TNKS
SCHEMBL15470313 0.86 ALOX5 (0.44) ALOX5PDE6DPRKDCPARP14TNKS
SCHEMBL15470276 0.85 ALOX5 (0.46) ALOX5PDE6DPRKDCPARP14TNKS

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