SCHEMBL25964838

SCHEMBL25964838

c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccccc6)c45)c3)nc(-c3cccc4c3oc3ccccc34)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.34
KDM4E B2RXH2 3/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPT P10636 4/20 0.32
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
PRKDC P78527 2/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CB P42338 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
GGPS1 O95749 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
SCHEMBL25964850 1.00 ALOX5 (0.34) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL25964853 0.94 ALOX5 (0.35) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL25964841 0.94 ALOX5 (0.35) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL25965180 0.94 PRKDC (0.34) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL25965160 0.94 PRKDC (0.34) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL24914598 0.93 ALOX5 (0.33) ALOX5KDM4EMAPTTSHRLMNA
SCHEMBL23602250 0.93 ALOX5 (0.33) ALOX5KDM4EMAPTTSHRLMNA
SCHEMBL18562337 0.93 KDM4E (0.33) KDM4EATML3MBTL1MAPT
SCHEMBL16810895 0.93 MAPT (0.33) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL19769872 0.93 KDM4E (0.34) ALOX5KDM4EATML3MBTL1MAPT

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