SCHEMBL21868262

SCHEMBL21868262

c1ccc2c(c1)Sc1ccccc1N2c1ccc2c(c1)-c1ccccc1C21c2ccccc2C2(c3ccccc3-c3ccccc32)c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.40
MAOA P21397 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
NOX1 Q9Y5S8 2/20 0.35
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
CHRM3 P20309 1/20 0.35
SLC6A2 P23975 1/20 0.35
HTR2C P28335 1/20 0.35
SLC6A4 P31645 1/20 0.35
DRD3 P35462 1/20 0.35
HTR2B P41595 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
BCHE P06276 5/20 0.33
ALDH1A1 P00352 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 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
SCHEMBL24905687 0.98 HDAC6 (0.41) HDAC6MAOAMEN1KMT2ANOX1
SCHEMBL19759958 0.90 HDAC6 (0.34) HDAC6MEN1KMT2ANOX1ADRA2A
SCHEMBL21688338 0.90 HDAC6 (0.41) HDAC6MAOAMEN1KMT2ANOX1
SCHEMBL15183545 0.90 HDAC6 (0.41) HDAC6MAOAMEN1KMT2ANOX1
SCHEMBL17929481 0.90 HDAC6 (0.36) HDAC6MAOAMEN1KMT2ANOX1
SCHEMBL21868074 0.89 HDAC6 (0.37) HDAC6MAOAMEN1KMT2ANOX1
SCHEMBL21868365 0.86 HDAC6 (0.40) HDAC6MAOABCHEALDH1A1HPGD
SCHEMBL13781069 0.85 HDAC6 (0.46) HDAC6NOX1L3MBTL1BCHELMNA
SCHEMBL14823501 0.84 HDAC6 (0.44) HDAC6MAOAMEN1KMT2ANOX1
SCHEMBL21477983 0.83 HDAC6 (0.35) HDAC6MAOA

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
US-20230024114-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2023-01-26 US disclosed
US-20220376178-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2022-11-24 US disclosed
WO-2020067823-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 주식회사 엘지화학 2020-04-02 WO disclosed