SCHEMBL28355358

SCHEMBL28355358

Cc1cc(F)c(Br)cc1NS(=O)(=O)c1ccc(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)cc1C(N)=O.[NaH].[NaH]

nearest known ligand 0.83

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SIRT6 Q8N6T7 3/20 0.83
▸ GPR27 Q9NS67 3/20 0.41
▸ ACLY P53396 4/20 0.41
▸ POLB P06746 1/20 0.40
▸ IDH1 O75874 5/20 0.38
▸ FABP4 P15090 1/20 0.38
▸ FABP5 Q01469 1/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ CHRM2 P08172 1/20 0.37
▸ CHRM1 P11229 1/20 0.37
▸ RRM1 P23921 1/20 0.37
▸ RRM2B Q7LG56 1/20 0.37

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
SCHEMBL23246158 1.00 SIRT6 (0.83) SIRT6GPR27ACLYPOLBIDH1
SCHEMBL23260610 0.99 SIRT6 (0.84) SIRT6GPR27ACLYPOLBIDH1
SCHEMBL28883674 0.98 SIRT6 (0.83) SIRT6GPR27ACLYPOLBIDH1
SCHEMBL23246163 0.98 SIRT6 (0.83) SIRT6GPR27ACLYPOLBIDH1
SCHEMBL29561258 0.91 SIRT6 (1.00) SIRT6GPR27ACLYFABP4FABP5
SCHEMBL28355158 0.91 SIRT6 (0.70) SIRT6GPR27ACLYFABP4FABP5
SCHEMBL23261498 0.90 SIRT6 (0.84) SIRT6GPR27ACLYIDH1FABP4
SCHEMBL28359044 0.90 SIRT6 (0.69) SIRT6GPR27ACLYFABP4FABP5
SCHEMBL23260705 0.89 SIRT6 (1.00) SIRT6GPR27ACLYIDH1FABP4
SCHEMBL29546685 0.89 SIRT6 (1.00) SIRT6GPR27ACLYIDH1FABP4

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-110642757-A Compound with activation SIRT6 acetylation activity, SIRT6 agonist and application thereof 上海交通大学医学院 2020-01-03 — — CN disclosed
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