SCHEMBL24314906

SCHEMBL24314906

C1=CC(c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4cccc5oc6c(-c7ccccc7)cccc6c45)n3)cc2)=CCC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.34
MAPT P10636 8/20 0.34
PIK3CB P42338 3/20 0.34
PIK3CG P48736 3/20 0.34
PRKDC P78527 2/20 0.34
PIK3CD O00329 2/20 0.34
PIK3CA P42336 2/20 0.34
ALDH1A1 P00352 6/20 0.33
KDM4E B2RXH2 4/20 0.33
TSHR P16473 4/20 0.33
LMNA P02545 4/20 0.33
HSD17B10 Q99714 3/20 0.33
MAPK1 P28482 2/20 0.33
POLB P06746 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
HPGD P15428 2/20 0.31
TP53 P04637 1/20 0.31
NFKB1 P19838 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
SCHEMBL24314925 1.00 ALOX5 (0.34) ALOX5MAPTPIK3CBPIK3CGPRKDC
SCHEMBL26037709 0.93 PRKDC (0.34) ALOX5MAPTPIK3CBPIK3CGPRKDC
SCHEMBL22174524 0.93 ALOX5 (0.36) ALOX5MAPTPIK3CBPIK3CGPRKDC
SCHEMBL25651784 0.92 MAPT (0.36) ALOX5MAPTPIK3CBPIK3CGPRKDC
SCHEMBL26225677 0.91 ALOX5 (0.36) ALOX5MAPTPIK3CBPIK3CGPRKDC
SCHEMBL26067051 0.91 TSHR (0.33) ALOX5MAPTPIK3CBPIK3CGPRKDC
SCHEMBL26892986 0.91 ALOX5 (0.34) ALOX5MAPTPRKDCALDH1A1KDM4E
SCHEMBL24314630 0.90 BACE1 (0.33) MAPTALDH1A1KDM4ETSHRLMNA
SCHEMBL24314784 0.89 ALOX5 (0.34) ALOX5PRKDCTSHR
SCHEMBL25832501 0.89 PRKDC (0.34) ALOX5MAPTPIK3CBPIK3CGPRKDC

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
EP-3972001-A1 ORGANIC LIGHT EMITTING DEVICE LG Chem, Ltd. (KR) 2022-03-23 EP disclosed