SCHEMBL23260622

SCHEMBL23260622

Cc1cc(F)c(Br)cc1NS(=O)(=O)c1ccc(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)cc1C#N

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SIRT6 Q8N6T7 3/20 0.70
▸ SLC22A12 Q96S37 9/20 0.45
▸ ACLY P53396 3/20 0.39
▸ PLA2G7 Q13093 1/20 0.38
▸ PKM P14618 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
SCHEMBL29561267 0.83 SIRT6 (0.72) SIRT6ACLYPKM
SCHEMBL29562488 0.83 SIRT6 (0.71) SIRT6
SCHEMBL29561557 0.83 SIRT6 (0.73) SIRT6ACLYPKM
SCHEMBL29561258 0.83 SIRT6 (1.00) SIRT6ACLY
SCHEMBL24625533 0.82 SIRT6 (0.67) SIRT6ACLYPKM
SCHEMBL23260610 0.82 SIRT6 (0.84) SIRT6ACLY
SCHEMBL23261499 0.82 SIRT6 (0.75) SIRT6PKM
SCHEMBL23261498 0.82 SIRT6 (0.84) SIRT6ACLY
SCHEMBL23246163 0.81 SIRT6 (0.83) SIRT6ACLY
SCHEMBL23260705 0.81 SIRT6 (1.00) SIRT6ACLY

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021073629-A1 COMPOUND HAVING EFFECT OF AGONIZING SIRT6 ACETYLATION ACTIVITY, SIRT6 AGONIST AND USE THEREOF 上海交通大学医学院 2021-04-22 — — WO disclosed
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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