SCHEMBL22315657

SCHEMBL22315657

c1ccc(-c2nc(-c3cc(-n4c5ccccc5c5cc6ccccc6cc54)c4oc5ccc6ccccc6c5c4c3)cc(-c3cccc4c3sc3ccccc34)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 2/20 0.34
ALOX5 P09917 1/20 0.31
PIK3CD O00329 1/20 0.30
PIK3CB P42338 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
SCHEMBL23738185 0.92 PRKDC (0.33) PRKDCALOX5PIK3CDPIK3CB
SCHEMBL23738101 0.85 PRKDC (0.32) PRKDCALOX5PIK3CDPIK3CB
SCHEMBL22316108 0.83 PRKDC (0.34) PRKDCALOX5PIK3CDPIK3CB
SCHEMBL23738128 0.83 PRKDC (0.32) PRKDCALOX5PIK3CDPIK3CB
SCHEMBL22762309 0.82 PRKDC (0.33) PRKDCALOX5
SCHEMBL22316086 0.82 PRKDC (0.35) PRKDCALOX5PIK3CDPIK3CB
SCHEMBL25051470 0.81
SCHEMBL23737541 0.81
SCHEMBL24739514 0.81 PRKDC (0.37) PRKDCALOX5PIK3CDPIK3CB
SCHEMBL24223598 0.81 PRKDC (0.35) PRKDCALOX5PIK3CDPIK3CB

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-2020159337-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2020-08-06 WO disclosed