SCHEMBL20344755

SCHEMBL20344755

CCCN1C(=O)CCc2cc(NSN(O)Cc3ccc(C)c(F)c3F)ccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATAD2 Q6PL18 1/20 0.36
POLB P06746 3/20 0.36
MAPT P10636 3/20 0.36
TP53 P04637 2/20 0.36
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35
CHRM1 P11229 4/20 0.35
CES2 O00748 1/20 0.35
HDAC1 Q13547 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
TRPV1 Q8NER1 2/20 0.33
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
DRD2 P14416 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
SCHEMBL20344749 0.88 GRIN1 (0.39) ATAD2POLBMAPTTP53GRIN1
SCHEMBL20344731 0.79 BRD4 (0.41) ATAD2POLBMAPTTP53GRIN1
SCHEMBL20344734 0.72 ATAD2 (0.38) ATAD2POLBMAPTTP53CHRM1
SCHEMBL20344815 0.70 HDAC1 (0.41) ATAD2POLBCHRM1CES2HDAC1
SCHEMBL18571318 0.69 HDAC1 (0.43) ATAD2POLBMAPTTP53GRIN1
SCHEMBL20344769 0.69 ATAD2 (0.36) ATAD2MAPTCHRM1CES2HDAC1
SCHEMBL30803804 0.67 BRD4 (0.41) ATAD2POLBMAPTTP53GRIN1
SCHEMBL20344748 0.67 BRD4 (0.41) ATAD2POLBMAPTTP53GRIN1
SCHEMBL20344751 0.67 BRD4 (0.41) ATAD2POLBMAPTTP53CHRM1
SCHEMBL20344739 0.67 BRD4 (0.42) ATAD2POLBMAPTTP53CHRM1

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
EP-3342766-A1 SMALL MOLECULE COMPOUND FOR ENHANCING PLANT STRESS RESISTANCE Shanghai Institutes for Biological Sciences, Chinese Academy of Sciences (CN) 2018-07-04 EP disclosed