SCHEMBL24905697

SCHEMBL24905697

c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2cccc(-c3c4ccccc4c(-c4cccc5c4sc4ccccc45)c4ccccc34)c21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.44
PARP14 Q460N5 1/20 0.42
GPR3 P46089 1/20 0.38
PRKDC P78527 9/20 0.35
PIK3CD O00329 2/20 0.34
PIK3CB P42338 2/20 0.34
BRD4 O60885 1/20 0.34
PIK3CA P42336 1/20 0.34
MTOR P42345 1/20 0.34
PIK3CG P48736 1/20 0.34
KCNH2 Q12809 1/20 0.34
BRDT Q58F21 1/20 0.34
MAPT P10636 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
RAB9A P51151 1/20 0.32
CCNC P24863 1/20 0.31
CDK8 P49336 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 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
SCHEMBL22707904 0.93 ALOX5 (0.46) ALOX5PARP14GPR3PRKDCPIK3CD
SCHEMBL15593062 0.92 PARP14 (0.48) ALOX5PARP14GPR3PRKDCPIK3CD
SCHEMBL22707899 0.86 ALOX5 (0.42) ALOX5PARP14GPR3PRKDCPIK3CD
SCHEMBL438622 0.85 PARP14 (0.50) ALOX5PARP14GPR3PRKDCPIK3CD
SCHEMBL9890847 0.85 ALOX5 (0.56) ALOX5PARP14GPR3PRKDCPIK3CD
SCHEMBL18374832 0.85 PARP14 (0.45) ALOX5PARP14GPR3PRKDCPIK3CD
SCHEMBL18156883 0.84 ALOX5 (0.43) ALOX5PARP14GPR3PRKDCPIK3CD
SCHEMBL19167966 0.84 ALOX5 (0.42) ALOX5PARP14GPR3PRKDCPIK3CD
SCHEMBL21450764 0.84 ALOX5 (0.54) ALOX5PARP14GPR3PRKDCPIK3CD
SCHEMBL22705897 0.83 ALOX5 (0.40) ALOX5PARP14PRKDCPIK3CDPIK3CB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230024114-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2023-01-26 US disclosed