SCHEMBL25965141

SCHEMBL25965141

c1ccc(-c2cccc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6nc(-c7ccccc7)nc(-c7ccc8c(c7)oc7c(-c9ccccc9)cccc78)n6)c5c43)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 2/20 0.35
ALOX5 P09917 1/20 0.34
PDE10A Q9Y233 1/20 0.32
GGPS1 O95749 1/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 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
SCHEMBL25009386 0.95 PRKDC (0.36) PRKDCALOX5PDE10AGGPS1PIK3CD
SCHEMBL24802385 0.95 PRKDC (0.36) PRKDCALOX5GGPS1PIK3CDPIK3CA
SCHEMBL25965143 0.94 PRKDC (0.36) PRKDCALOX5PDE10AGGPS1PIK3CD
SCHEMBL23601884 0.94 PRKDC (0.34) PRKDCALOX5GGPS1
SCHEMBL24390427 0.94 PRKDC (0.36) PRKDCALOX5GGPS1PIK3CDPIK3CA
SCHEMBL25965111 0.94 ALOX5 (0.37) PRKDCALOX5PDE10AGGPS1PIK3CD
SCHEMBL24882945 0.93 ALOX5 (0.38) PRKDCALOX5PDE10AGGPS1PIK3CD
SCHEMBL24390425 0.93 PRKDC (0.34) PRKDCALOX5GGPS1
SCHEMBL23602351 0.93 ALOX5 (0.35) PRKDCALOX5PDE10AGGPS1PIK3CD
SCHEMBL24882795 0.92 ALOX5 (0.39) PRKDCALOX5GGPS1PIK3CDPIK3CA

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-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 US disclosed
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 US disclosed