SCHEMBL20344779

SCHEMBL20344779

C=C1C=Cc2cc(NS(=O)(=O)Cc3ccc(C)c(P)c3)ccc2N1CCC

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 4/20 0.36
BRPF1 P55201 2/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
ATM Q13315 2/20 0.33
MAPT P10636 2/20 0.33
POLB P06746 1/20 0.32
BRAF P15056 1/20 0.32
IMPDH2 P12268 1/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPC1 O15118 1/20 0.31
BRD4 O60885 2/20 0.30
GAA P10253 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
SCHEMBL20344759 0.77 BRAF (0.31) BRPF1BRAFHPGDBRD4
SCHEMBL20344802 0.70 HDAC8 (0.34) HDAC8BRPF1HDAC1HDAC6ATM
SCHEMBL20344751 0.68 BRD4 (0.41) HDAC8BRPF1HDAC1HDAC6MAPT
SCHEMBL20344770 0.68 BRD4 (0.41) HDAC8BRPF1HDAC1HDAC6POLB
SCHEMBL24519716 0.68 MEN1 (0.32) HDAC1HDAC6MAPTPOLBLMNA
SCHEMBL20616467 0.65 BRD4 (0.39) HDAC8BRPF1HDAC1HDAC6LMNA
SCHEMBL20616466 0.65 BRD4 (0.36) HDAC8BRPF1HDAC1HDAC6MAPT
SCHEMBL15298954 0.65 BRD4 (0.44) HDAC8BRPF1HDAC1HDAC6MAPT
SCHEMBL20616472 0.65 PKM (0.37) HDAC8BRPF1HDAC1HDAC6POLB
SCHEMBL20616456 0.64 BRD4 (0.40) HDAC8BRPF1HDAC1HDAC6MAPT

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