SCHEMBL24152199

SCHEMBL24152199

c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5ccc6ccccc6c54)c3)nc(-c3cccc4c3oc3ccccc34)n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.35
MAPT P10636 5/20 0.33
SIRT2 Q8IXJ6 1/20 0.33
SIRT1 Q96EB6 1/20 0.33
KDM4E B2RXH2 3/20 0.33
TSHR P16473 3/20 0.33
MAPK1 P28482 2/20 0.33
HSD17B10 Q99714 2/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
ATM Q13315 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL24152032 0.93 SIRT2 (0.35) ALOX5MAPTSIRT2SIRT1KDM4E
SCHEMBL22049192 0.93 ALOX5 (0.37) ALOX5MAPTKDM4ETSHRMAPK1
SCHEMBL24216597 0.92 ALOX5 (0.37) ALOX5MAPTKDM4ETSHRMAPK1
SCHEMBL24151852 0.92 ALOX5 (0.37) ALOX5MAPTSIRT2SIRT1KDM4E
SCHEMBL25964825 0.90 ALOX5 (0.38) ALOX5MAPTKDM4ETSHRMAPK1
SCHEMBL24152165 0.90 SIRT2 (0.34) MAPTSIRT2SIRT1KDM4ETSHR
SCHEMBL24157314 0.90 ALOX5 (0.36) ALOX5MAPTKDM4ETSHRMAPK1
SCHEMBL24363518 0.90 SIRT2 (0.33) ALOX5MAPTSIRT2SIRT1KDM4E
SCHEMBL19082974 0.90 ALOX5 (0.40) ALOX5MAPTKDM4ETSHRMAPK1
SCHEMBL17990719 0.90 MAPT (0.37) ALOX5MAPTKDM4ETSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021261907-A1 ORGANIC LIGHT EMITTING DEVICE 주식회사 엘지화학 2021-12-30 WO disclosed
WO-2021261977-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2021-12-30 WO disclosed
WO-2021261962-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2021-12-30 WO disclosed