SCHEMBL23246166

SCHEMBL23246166

Cc1cc(F)c(Br)cc1NS(=O)(=O)c1ccc(N)cc1-n1cccc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SIRT6 Q8N6T7 3/20 0.44
▸ BRD4 O60885 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ CCR2 P41597 3/20 0.34
▸ GAA P10253 2/20 0.34
▸ POLB P06746 2/20 0.34
▸ NMT1 P30419 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MAPT P10636 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ APOBEC3G Q9HC16 1/20 0.34
▸ GPR55 Q9Y2T6 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PKM P14618 1/20 0.33

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
SCHEMBL23260707 0.80 SIRT6 (0.68) SIRT6ALDH1A1MAPTMEN1KMT2A
SCHEMBL23246177 0.77 SIRT6 (0.49) SIRT6POLB
SCHEMBL23246160 0.76 SIRT6 (0.67) SIRT6BRD4GAA
SCHEMBL23246171 0.70 NHERF1 (0.47) SIRT6ALDH1A1POLBSMN1; SMN2MAPT
SCHEMBL23261505 0.66 POLB (0.50) SIRT6ALDH1A1POLBSMN1; SMN2PKM
SCHEMBL29561189 0.65 SIRT6 (0.65) SIRT6ALDH1A1CCR2GAAMAPT
SCHEMBL10915039 0.63 ALDH1A1 (0.57) ALDH1A1GAASMN1; SMN2MAPTKDM4E
SCHEMBL10915888 0.63 LMNA (0.50) BRD4ALDH1A1GAASMN1; SMN2MAPT
SCHEMBL23246167 0.63 SIRT6 (0.62) SIRT6BRD4ALDH1A1GAAPOLB
SCHEMBL2120261 0.62 KMT2A (0.52) ALDH1A1POLBSMN1; SMN2MAPTKDM4E

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 3 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
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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