SCHEMBL28920120

SCHEMBL28920120

O=C(O)C=Cc1cc(F)c(NS(=O)(=O)c2c[nH]c3cc(Cl)ccc23)nc1F

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TDO2 P48775 3/20 0.44
▸ CPT1A P50416 1/20 0.36
▸ CPT1B Q92523 1/20 0.36
▸ NR4A2 P43354 1/20 0.35
▸ SGK1 O00141 4/20 0.34
▸ CCR2 P41597 2/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC8 Q9BY41 1/20 0.33
▸ PLA2G1B P04054 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ ATG4B Q9Y4P1 1/20 0.33
▸ BCHE P06276 1/20 0.32
▸ ACHE P22303 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ MAPK1 P28482 1/20 0.32

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
SCHEMBL20344346 1.00 TDO2 (0.44) TDO2CPT1ACPT1BNR4A2SGK1
SCHEMBL29559912 0.87 MEN1 (0.38) NR4A2MAPT
SCHEMBL20354908 0.87 MEN1 (0.38) NR4A2MAPT
SCHEMBL28993275 0.87 MEN1 (0.38) NR4A2MAPT
SCHEMBL20354925 0.85 SGK1 (0.36) TDO2NR4A2SGK1CCR2
SCHEMBL20354864 0.83 TDO2 (0.39) TDO2NR4A2SGK1CCR2
SCHEMBL20339122 0.83 MEN1 (0.37) TDO2NR4A2SGK1CCR2
SCHEMBL20354912 0.83 CCR2 (0.35) TDO2NR4A2SGK1CCR2MAPT
SCHEMBL30286436 0.81 CCR4 (0.39) TDO2NR4A2SGK1CCR2
SCHEMBL20354911 0.81 CCR4 (0.39) TDO2NR4A2SGK1CCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110121499-B (aza) indole-, benzothiophene-and benzofuran-3-sulfonamides 优时比制药有限公司 2022-12-20 — — CN claimed
CN-116283712-A (aza) indole-, benzothiophene-and benzofuran-3-sulfonamides 优时比制药有限公司 2023-06-23 — — CN disclosed
CN-116036078-A (aza) indole-, benzothiophene-and benzofuran-3-sulfonamides 优时比制药有限公司 2023-05-02 — — CN disclosed
CN-110121499-B (aza) indole-, benzothiophene-and benzofuran-3-sulfonamides 优时比制药有限公司 2022-12-20 — — CN disclosed
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