SCHEMBL15470342

SCHEMBL15470342

Cc1ccc2c(c1)N(c1cccc(-c3ccccc3)c1)c1cc(C)ccc1N2c1ccc(-c2cccc3c2sc2ccccc23)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
PRKDC P78527 4/20 0.36
PARP14 Q460N5 1/20 0.34
ALDH1A1 P00352 2/20 0.33
FAAH O00519 1/20 0.33
HSP90AA1 P07900 1/20 0.33
PKM P14618 1/20 0.33
HTT P42858 1/20 0.33
ATM Q13315 1/20 0.33
MGLL Q99685 1/20 0.33
PIM3 Q86V86 1/20 0.31
PMM2 O15305 2/20 0.31
MPI P34949 2/20 0.31
PHOSPHO1 Q8TCT1 2/20 0.31
TNKS O95271 2/20 0.31
TNKS2 Q9H2K2 2/20 0.31
PDE6D O43924 1/20 0.31
F9 P00740 1/20 0.31
PIK3CD O00329 1/20 0.31
BRD4 O60885 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
SCHEMBL15470350 0.91 ALOX5 (0.42) ALOX5PRKDCPARP14PMM2MPI
SCHEMBL15470346 0.89 ALOX5 (0.48) ALOX5PRKDCPARP14ALDH1A1FAAH
SCHEMBL15470314 0.87 ALOX5 (0.42) ALOX5PRKDCPARP14TNKSTNKS2
SCHEMBL15470281 0.86 ALOX5 (0.41) ALOX5PRKDCPARP14HTTTNKS
SCHEMBL15470338 0.85 ALOX5 (0.46) ALOX5PRKDCPARP14HTTPIM3
SCHEMBL15470340 0.84 ALOX5 (0.51) ALOX5PRKDCPARP14FAAHMGLL
SCHEMBL15470310 0.83 ALOX5 (0.46) ALOX5PRKDCPARP14ATMPMM2
SCHEMBL15470274 0.82 ALOX5 (0.45) ALOX5PRKDCPARP14HTTTNKS
SCHEMBL15470312 0.81 ALOX5 (0.47) ALOX5PRKDCPARP14FAAHMGLL
SCHEMBL16884810 0.81 ALOX5 (0.52) ALOX5PRKDCPARP14ALDH1A1FAAH

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