SCHEMBL23961024

SCHEMBL23961024

c1ccc(-c2ccccc2-c2cccc(-n3c4ccc5c(c6ccccc6n5-c5ccccc5)c4c4ccc5ccccc5c43)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
MAPK14 Q16539 1/20 0.33
KMT2A Q03164 2/20 0.32
IL1R1 P14778 1/20 0.32
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32
MCL1 Q07820 1/20 0.31
BAD Q92934 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
PDE10A Q9Y233 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
CDK4 P11802 3/20 0.31
CCND1 P24385 3/20 0.31
JAK2 O60674 1/20 0.31
JAK3 P52333 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
SCHEMBL23960923 1.00 L3MBTL1 (0.39) L3MBTL1KDM4EATMMAPK14KMT2A
SCHEMBL23960921 0.92 L3MBTL1 (0.38) L3MBTL1KDM4EATMMAPK14KMT2A
SCHEMBL23961006 0.92 L3MBTL1 (0.41) L3MBTL1KDM4EATMMAPK14KMT2A
SCHEMBL22186225 0.92 L3MBTL1 (0.41) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL19359858 0.90 ATM (0.39) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL23961027 0.90 CDK4 (0.35) KDM4EKMT2AMAPTMEN1ALDH1A1
SCHEMBL22186717 0.89 L3MBTL1 (0.40) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL22186621 0.88 SIRT2 (0.34) L3MBTL1KDM4EATM
SCHEMBL23960989 0.88 SIRT2 (0.34) L3MBTL1KDM4EATM
SCHEMBL24230838 0.88 L3MBTL1 (0.50) L3MBTL1KDM4EATMMAPK14KMT2A

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-20210336153-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, A PLURALITY OF HOST MATERIALS, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2021-10-28 US disclosed