SCHEMBL21868581

SCHEMBL21868581

c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc(-c3ccc4c(c3)-c3ccccc3C43c4ccccc4-n4c5ccccc5c5cccc3c54)n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
DUSP3 P51452 1/20 0.32
PDE6D O43924 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
SCHEMBL24293779 0.96 DUSP3 (0.34) KDM4EATMDUSP3
SCHEMBL21868569 0.95 DUSP3 (0.34) KDM4EATMDUSP3
SCHEMBL21868588 0.93 DUSP3 (0.33) KDM4EATMDUSP3
SCHEMBL23789854 0.93 DUSP3 (0.34) KDM4EATMDUSP3
SCHEMBL21867775 0.92 MEN1 (0.33) KDM4EATML3MBTL1DUSP3
SCHEMBL24293617 0.92 MEN1 (0.34) KDM4EATML3MBTL1DUSP3PDE6D
SCHEMBL21868567 0.92 DUSP3 (0.32) DUSP3
SCHEMBL24293614 0.92 DUSP3 (0.33) DUSP3
SCHEMBL24905033 0.92 DUSP3 (0.33) DUSP3
SCHEMBL24293639 0.92 DUSP3 (0.33) DUSP3

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-20230024114-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2023-01-26 US disclosed
WO-2020067823-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 주식회사 엘지화학 2020-04-02 WO disclosed