SCHEMBL25458348

SCHEMBL25458348

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5c4oc4c(-c6ccc7oc8cc(-n9c%10ccccc%10c%10cc(-c%11ccccc%11)ccc%109)ccc8c7c6)cccc45)n3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.36
PRKDC P78527 3/20 0.34
PLA2G2A P14555 2/20 0.32
PLA2G4A P47712 2/20 0.32
PIM1 P11309 1/20 0.32
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
PIM3 Q86V86 1/20 0.32
PIM2 Q9P1W9 1/20 0.32
PTGER4 P35408 1/20 0.32
PLA2G10 O15496 1/20 0.31
GGPS1 O95749 1/20 0.31
PIK3CD O00329 1/20 0.30
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
PIK3CG P48736 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
SCHEMBL25458373 0.99 ALOX5 (0.35) ALOX5PRKDCPLA2G2APLA2G4APIM1
SCHEMBL23823855 0.97 PRKDC (0.35) ALOX5PRKDCPLA2G2APLA2G4APIM1
SCHEMBL25458449 0.97 ALOX5 (0.39) ALOX5PRKDCPLA2G2APLA2G4APIM1
SCHEMBL25458332 0.96 PRKDC (0.35) ALOX5PRKDCPTGER4PIK3CDPIK3CA
SCHEMBL25458483 0.96 ALOX5 (0.35) ALOX5PRKDCPLA2G2APLA2G4APIM1
SCHEMBL25700403 0.96 ALOX5 (0.38) ALOX5PRKDCPLA2G2APLA2G4APTGER4
SCHEMBL25458951 0.95 ALOX5 (0.39) ALOX5PRKDCPLA2G2APLA2G4APIM1
SCHEMBL25458730 0.95 ALOX5 (0.39) ALOX5PRKDCPLA2G2APLA2G4APIM1
SCHEMBL25458918 0.95 ALOX5 (0.39) ALOX5PRKDCPLA2G2APLA2G4APIM1
SCHEMBL25458505 0.95 ALOX5 (0.34) ALOX5PRKDCPLA2G2APLA2G4APIM1

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