SCHEMBL29976182

SCHEMBL29976182

O=C1c2c(-c3ccccc3)cccc2-c2cccc(-c3ccccc3)c21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.52
HDAC2 Q92769 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HNF4A P41235 1/20 0.47
MAPT P10636 6/20 0.46
LMNA P02545 5/20 0.46
HTT P42858 4/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
CDC25B P30305 2/20 0.46
ALDH1A1 P00352 3/20 0.45
ADORA2A P29274 1/20 0.44
ADORA1 P30542 1/20 0.44
MAPK1 P28482 3/20 0.44
KDM4E B2RXH2 2/20 0.44
PLK4 O00444 1/20 0.44
MAPK9 P45984 1/20 0.44
LIMK1 P53667 1/20 0.44
CLK4 Q9HAZ1 1/20 0.44

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
SCHEMBL24736915 1.00 HDAC4 (0.52) HDAC4HDAC2HDAC8HDAC6HNF4A
SCHEMBL22797324 0.93 HDAC4 (0.50) HDAC4HDAC2HDAC8HDAC6HNF4A
SCHEMBL12626745 0.93 MAPT (0.52) HDAC4HDAC2HDAC8HDAC6HNF4A
SCHEMBL29595074 0.91 LMNA (0.59) HDAC4HDAC2HDAC8HDAC6HNF4A
SCHEMBL978805 0.91 MAPT (0.57) HDAC4HDAC2HDAC8HDAC6MAPT
SCHEMBL11424452 0.90 HDAC4 (0.52) HDAC4HDAC2HDAC8HDAC6HNF4A
SCHEMBL27971257 0.88 HDAC4 (0.50) HDAC4HDAC2HDAC8HDAC6HNF4A
SCHEMBL1038974 0.86 ADORA2A (0.57) HDAC4HDAC2HDAC8HDAC6MAPT
SCHEMBL22187708 0.85 MEN1 (0.52) HDAC4HDAC2HDAC8HDAC6HNF4A
SCHEMBL27530459 0.84 LMNA (0.50) HDAC4HDAC2HDAC8HDAC6MAPT

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
CN-115124577-A Organic electroluminescent device and organic metal compound for organic electroluminescent device 三星显示有限公司 2022-09-30 CN disclosed