SCHEMBL15470314

SCHEMBL15470314

Cc1ccc2c(c1)Sc1cc(-c3ccccc3)ccc1N2c1ccc(-c2ccc(-c3cccc4c3sc3ccccc34)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.42
PRKDC P78527 4/20 0.36
PARP14 Q460N5 1/20 0.33
PDE6D O43924 1/20 0.31
TNKS O95271 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
F9 P00740 1/20 0.31
PIK3CD O00329 1/20 0.30
BRD4 O60885 1/20 0.30
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
MTOR P42345 1/20 0.30
PIK3CG P48736 1/20 0.30
KCNH2 Q12809 1/20 0.30
BRDT Q58F21 1/20 0.30
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 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
SCHEMBL15470310 0.95 ALOX5 (0.46) ALOX5PRKDCPARP14TNKSTNKS2
SCHEMBL15470312 0.94 ALOX5 (0.47) ALOX5PRKDCPARP14PDE6DTNKS
SCHEMBL15470313 0.91 ALOX5 (0.44) ALOX5PRKDCPARP14PDE6DTNKS
SCHEMBL15470321 0.88 ALOX5 (0.45) ALOX5PRKDCPARP14PDE6DTNKS
SCHEMBL15470342 0.87 ALOX5 (0.43) ALOX5PRKDCPARP14PDE6DTNKS
SCHEMBL15470211 0.86 PIM3 (0.33) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL15470350 0.86 ALOX5 (0.42) ALOX5PRKDCPARP14PDE6DTNKS
SCHEMBL15470281 0.85 ALOX5 (0.41) ALOX5PRKDCPARP14PDE6DTNKS
SCHEMBL15470207 0.82 GPR3 (0.34) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL15470338 0.82 ALOX5 (0.46) ALOX5PRKDCPARP14PDE6DTNKS

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