SCHEMBL28297841

SCHEMBL28297841

Br[Pb](Br)(Br)Br.CCCC(=O)NC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 4/20 0.50
HDAC1 Q13547 4/20 0.50
HDAC2 Q92769 4/20 0.50
HDAC8 Q9BY41 4/20 0.50
HDAC6 Q9UBN7 1/20 0.50
CTSD P07339 1/20 0.48
LMNA P02545 1/20 0.46
CASP2 P42575 1/20 0.40
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
FFAR3 O14843 3/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.36
MCL1 Q07820 1/20 0.36
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALOX5 P09917 1/20 0.35

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
SCHEMBL42695 0.89
Hydrochloric Acid SCHEMBL5038099 0.87
Water SCHEMBL8723991 0.87
SCHEMBL5829953 0.87
Water SCHEMBL8723987 0.87 HDAC3 (0.57) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL6522181 0.87
SCHEMBL106749 0.87
Methylamine SCHEMBL3638546 0.84
Hydrochloric Acid SCHEMBL5883931 0.84 HDAC3 (0.55) HDAC3HDAC1HDAC2HDAC8HDAC6
Formic Acid SCHEMBL28494572 0.80 HDAC3 (0.50) HDAC3HDAC1HDAC2HDAC8HDAC6

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-109817812-A Bulky grain perovskite monocrystalline/polymer composite thick film, photodetector and preparation method 武汉大学 2019-05-28 CN disclosed