SCHEMBL15469805

SCHEMBL15469805

c1ccc(N(c2ccc(-c3cccc4c3sc3ccccc34)cc2)c2ccc3c(c2)Oc2ccccc2N3c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.40
PRKDC P78527 3/20 0.36
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
ADK P55263 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
SCHEMBL15469823 0.97 ALOX5 (0.39) ALOX5PRKDCPIK3CDBRD4PIK3CA
SCHEMBL15469877 0.95 ALOX5 (0.39) ALOX5PRKDCPIK3CDBRD4PIK3CA
SCHEMBL15469927 0.93 ALOX5 (0.39) ALOX5PRKDCPIK3CDBRD4PIK3CA
SCHEMBL15469798 0.91 ALOX5 (0.36) ALOX5PRKDC
SCHEMBL10044699 0.91 ALOX5 (0.35) ALOX5PRKDC
SCHEMBL15469851 0.90 ALOX5 (0.34) ALOX5PRKDC
SCHEMBL15469773 0.87
SCHEMBL15469954 0.87 ALOX5 (0.33) ALOX5PRKDC
SCHEMBL15469904 0.87 ALOX5 (0.36) ALOX5PRKDC
SCHEMBL15469829 0.86 TNKS (0.31) ALOX5

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