SCHEMBL25459237

SCHEMBL25459237

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5oc6cc(-c7cccc(-c8cccc9c8sc8ccccc89)c7)ccc6c45)n3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 7/20 0.46
ALOX5 P09917 1/20 0.45
PIK3CD O00329 2/20 0.33
PIK3CB P42338 2/20 0.33
MAPT P10636 1/20 0.32
BRD4 O60885 1/20 0.32
PIK3CA P42336 1/20 0.32
MTOR P42345 1/20 0.32
PIK3CG P48736 1/20 0.32
KCNH2 Q12809 1/20 0.32
BRDT Q58F21 1/20 0.32
LIMK1 P53667 3/20 0.31
PARP14 Q460N5 1/20 0.31
PLA2G2A P14555 1/20 0.31
PLA2G4A P47712 1/20 0.31
DNPH1 O43598 1/20 0.31
ESR2 Q92731 1/20 0.31
PIM3 Q86V86 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
SCHEMBL24216611 1.00 PRKDC (0.46) PRKDCALOX5PIK3CDPIK3CBMAPT
SCHEMBL21425337 0.99 PRKDC (0.45) PRKDCALOX5PIK3CDPIK3CBMAPT
SCHEMBL24216461 0.98 PRKDC (0.47) PRKDCALOX5PIK3CDPIK3CBMAPT
SCHEMBL25459234 0.97 PRKDC (0.44) PRKDCALOX5PIK3CDPIK3CBMAPT
SCHEMBL24216599 0.97 PRKDC (0.48) PRKDCALOX5PIK3CDPIK3CBMAPT
SCHEMBL25459328 0.96 PRKDC (0.46) PRKDCALOX5PIK3CDPIK3CBMAPT
SCHEMBL24216464 0.96 PRKDC (0.47) PRKDCALOX5PIK3CDPIK3CBMAPT
SCHEMBL24216339 0.96 PRKDC (0.47) PRKDCALOX5PIK3CDPIK3CBMAPT
SCHEMBL25459331 0.96 PRKDC (0.47) PRKDCALOX5PIK3CDPIK3CBMAPT
SCHEMBL21425048 0.96 ALOX5 (0.46) PRKDCALOX5PIK3CDPIK3CBMAPT

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