SCHEMBL15470306

SCHEMBL15470306

c1ccc2c(c1)Sc1ccccc1N2c1ccc(-c2cccc3c2sc2ccccc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.49
HDAC6 Q9UBN7 1/20 0.40
PRKDC P78527 4/20 0.40
PARP14 Q460N5 1/20 0.38
BCHE P06276 7/20 0.35
SLC6A3 Q01959 1/20 0.35
PIK3CD O00329 2/20 0.33
PIK3CB P42338 2/20 0.33
BRD4 O60885 1/20 0.33
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33
PIK3CG P48736 1/20 0.33
KCNH2 Q12809 1/20 0.33
BRDT Q58F21 1/20 0.33
GPR3 P46089 1/20 0.33
ADK P55263 1/20 0.33
MAOA P21397 1/20 0.33
ACHE P22303 2/20 0.32
PDE6D O43924 1/20 0.32
TNKS O95271 1/20 0.32

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
SCHEMBL15470313 0.91 ALOX5 (0.44) ALOX5HDAC6PRKDCPARP14BCHE
SCHEMBL15470312 0.87 ALOX5 (0.47) ALOX5PRKDCPARP14PIK3CDPIK3CB
SCHEMBL15470340 0.86 ALOX5 (0.51) ALOX5PRKDCPARP14PIK3CDPIK3CB
SCHEMBL17278619 0.86 ALOX5 (0.39) ALOX5HDAC6PRKDCPARP14BCHE
SCHEMBL15470310 0.86 ALOX5 (0.46) ALOX5PRKDCPARP14BCHEPIK3CD
SCHEMBL21915585 0.83 ALOX5 (0.37) ALOX5HDAC6PRKDCPARP14BCHE
SCHEMBL15469990 0.83 ALOX5 (0.40) ALOX5PRKDCBCHE
SCHEMBL15470275 0.83 ALOX5 (0.48) ALOX5PRKDCPARP14PIK3CDPIK3CB
SCHEMBL13427128 0.83 ALOX5 (0.40) ALOX5HDAC6PRKDCPARP14BCHE
SCHEMBL15470321 0.81 ALOX5 (0.45) ALOX5PRKDCPARP14PIK3CDPIK3CB

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