SCHEMBL30286231

SCHEMBL30286231

COc1ccc2c(S(=O)(=O)Nc3ncc(Cl)cc3F)c[nH]c2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR4 P51679 4/20 0.40
▸ MAPT P10636 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ HTT P42858 2/20 0.39
▸ PRKAB2 O43741 2/20 0.39
▸ PRKAG1 P54619 2/20 0.39
▸ PRKAA2 P54646 2/20 0.39
▸ PRKAA1 Q13131 2/20 0.39
▸ PRKAG3 Q9UGI9 2/20 0.39
▸ PRKAG2 Q9UGJ0 2/20 0.39
▸ PRKAB1 Q9Y478 2/20 0.39
▸ SLC40A1 Q9NP59 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ GAA P10253 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ DYRK1A Q13627 1/20 0.39
▸ SGK1 O00141 4/20 0.39

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
SCHEMBL21545849 1.00 CCR4 (0.40) CCR4MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL20355182 0.87 CCR2 (0.41) CCR4SLC40A1DYRK1ASGK1
SCHEMBL20339189 0.84 S100A9 (0.38) CCR4SLC40A1SGK1
SCHEMBL20340285 0.83 CCR2 (0.46) MAPTKDM4EALDH1A1SMN1; SMN2HTT
SCHEMBL20354726 0.81 SLC40A1 (0.44) CCR4HTTSLC40A1LMNASGK1
SCHEMBL30286500 0.81 SLC40A1 (0.44) CCR4HTTSLC40A1LMNASGK1
SCHEMBL21545847 0.81 SCN9A (0.42) CCR4SLC40A1DYRK1ASGK1
SCHEMBL30286487 0.81 SCN9A (0.42) CCR4SLC40A1DYRK1ASGK1
SCHEMBL21545905 0.80 CCR4 (0.38) CCR4HTTDYRK1ASGK1KMT2A
SCHEMBL30286524 0.80 CCR4 (0.38) CCR4HTTDYRK1ASGK1KMT2A

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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