SCHEMBL19021709

SCHEMBL19021709

C1=CC(c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5cccc6c5oc5ccccc56)ccc43)n2)=CCC1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.39
PRKDC P78527 5/20 0.35
GGPS1 O95749 1/20 0.33
PIK3CD O00329 1/20 0.32
PIK3CB P42338 1/20 0.32
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
PTGES2 Q9H7Z7 1/20 0.31
ATM Q13315 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
SCHEMBL31634 0.89 ALOX5 (0.47) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL15294002 0.87 ALOX5 (0.46) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL15371782 0.87 ALOX5 (0.49) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL15294052 0.86 ALOX5 (0.45) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL17814835 0.86
SCHEMBL15294070 0.85 ALOX5 (0.43) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL15294058 0.85 ALOX5 (0.43) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL15294065 0.84 ALOX5 (0.42) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL15294078 0.84 ALOX5 (0.42) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL16185385 0.84 ALOX5 (0.47) ALOX5PRKDCGGPS1PIK3CDPIK3CB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017105040-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2017-06-22 WO disclosed