SCHEMBL25458449

SCHEMBL25458449

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5c4oc4ccc(-c6cccc7c6oc6cc(-n8c9ccccc9c9cc(-c%10ccccc%10)ccc98)ccc67)cc45)n3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.39
PRKDC P78527 3/20 0.36
PIM1 P11309 1/20 0.34
CSNK2A2 P19784 1/20 0.34
CSNK2B P67870 1/20 0.34
PIM3 Q86V86 1/20 0.34
PIM2 Q9P1W9 1/20 0.34
GGPS1 O95749 1/20 0.33
PTPRF P10586 6/20 0.31
PTPN2 P17706 6/20 0.31
PTPN1 P18031 6/20 0.31
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
PTGES2 Q9H7Z7 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
MAPT P10636 1/20 0.31
PLA2G2A P14555 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
SCHEMBL25458348 0.97 ALOX5 (0.36) ALOX5PRKDCPIM1CSNK2A2CSNK2B
SCHEMBL25458483 0.97 ALOX5 (0.35) ALOX5PRKDCPIM1CSNK2A2CSNK2B
SCHEMBL25458373 0.96 ALOX5 (0.35) ALOX5PRKDCPIM1CSNK2A2CSNK2B
SCHEMBL25458951 0.96 ALOX5 (0.39) ALOX5PRKDCPIM1CSNK2A2CSNK2B
SCHEMBL25458918 0.96 ALOX5 (0.39) ALOX5PRKDCPIM1CSNK2A2CSNK2B
SCHEMBL25458730 0.96 ALOX5 (0.39) ALOX5PRKDCPIM1CSNK2A2CSNK2B
SCHEMBL25458505 0.96 ALOX5 (0.34) ALOX5PRKDCPIM1CSNK2A2CSNK2B
SCHEMBL24217179 0.96 ALOX5 (0.36) ALOX5PRKDCPIM1CSNK2A2CSNK2B
SCHEMBL25458460 0.96 PRKDC (0.35) ALOX5PRKDCPIM1CSNK2A2CSNK2B
SCHEMBL25926357 0.96 ALOX5 (0.41) ALOX5PRKDCPIM1CSNK2A2CSNK2B

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-20230157151-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-05-18 US disclosed
US-20230157151-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-05-18 US disclosed