SCHEMBL23960957

SCHEMBL23960957

c1ccc(-n2c3ccccc3c3cc4c5ccccc5n(-c5cccc(-c6cccc7sc8ccccc8c67)c5)c4cc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
ATM Q13315 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HSD17B10 Q99714 1/20 0.34
BRDT Q58F21 1/20 0.33
LIMK1 P53667 1/20 0.33
KMT2A Q03164 3/20 0.33
IL1R1 P14778 1/20 0.33
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
F9 P00740 1/20 0.32
ALOX5 P09917 1/20 0.32
GAA P10253 1/20 0.32
PDE1B Q01064 1/20 0.31
PDE3A Q14432 1/20 0.31
PDE11A Q9HCR9 1/20 0.31
GPR3 P46089 1/20 0.30
LMNA P02545 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
SCHEMBL17206509 0.93 KDM4E (0.36) L3MBTL1ATMKDM4EBRDTLIMK1
SCHEMBL25127975 0.93 L3MBTL1 (0.42) L3MBTL1ATMKDM4EHSD17B10BRDT
SCHEMBL23309005 0.92 L3MBTL1 (0.36) L3MBTL1ATMKDM4EBRDTLIMK1
SCHEMBL16545694 0.92 L3MBTL1 (0.42) L3MBTL1ATMKDM4EHSD17B10BRDT
SCHEMBL18505105 0.92 ATM (0.44) L3MBTL1ATMKDM4EHSD17B10BRDT
SCHEMBL22672112 0.91 L3MBTL1 (0.39) L3MBTL1ATMKDM4EHSD17B10BRDT
SCHEMBL17285326 0.91 L3MBTL1 (0.39) L3MBTL1ATMKDM4EHSD17B10BRDT
SCHEMBL22186246 0.91 KDM4E (0.35) L3MBTL1ATMKDM4E
SCHEMBL22960410 0.91 KDM4E (0.35) L3MBTL1ATMKDM4E
SCHEMBL17660918 0.91 ATM (0.41) L3MBTL1ATMKDM4EHSD17B10BRDT

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