SCHEMBL21545874

SCHEMBL21545874

O=S(=O)(Nc1ncc(COC(F)F)cc1F)c1c[nH]c2cc(Cl)ccc12

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SGK1 O00141 8/20 0.35
▸ CYP2C9 P11712 2/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ CCR4 P51679 2/20 0.33
▸ TDO2 P48775 1/20 0.33
▸ ALPL P05186 2/20 0.32
▸ NR4A2 P43354 1/20 0.32
▸ SCN9A Q15858 2/20 0.32
▸ CNR1 P21554 1/20 0.32
▸ CCR2 P41597 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
SCHEMBL30286456 1.00 SGK1 (0.35) SGK1CYP2C9CYP2C19CCR4TDO2
SCHEMBL21545905 0.89 CCR4 (0.38) SGK1CYP2C9CYP2C19CCR4ALPL
SCHEMBL30286524 0.89 CCR4 (0.38) SGK1CYP2C9CYP2C19CCR4ALPL
SCHEMBL20344327 0.87 PIK3CD (0.32) SGK1CYP2C9CYP2C19CCR2
SCHEMBL20355182 0.84 CCR2 (0.41) SGK1CYP2C9CYP2C19CCR4ALPL
SCHEMBL30286487 0.82 SCN9A (0.42) SGK1CYP2C9CYP2C19CCR4TDO2
SCHEMBL21545847 0.82 SCN9A (0.42) SGK1CYP2C9CYP2C19CCR4TDO2
SCHEMBL20354726 0.80 SLC40A1 (0.44) SGK1CYP2C19CCR4ALPLNR4A2
SCHEMBL20355390 0.80 CCR4 (0.39) SGK1CYP2C9CYP2C19CCR4TDO2
SCHEMBL30286500 0.80 SLC40A1 (0.44) SGK1CYP2C19CCR4ALPLNR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12071404-B2 Aza (indole)-, benzothiophene-, and benzofuran-3-sulfonamides UCB PHARMA GMBH (DE) 2024-08-27 — — US claimed
CN-110121499-B (aza) indole-, benzothiophene-and benzofuran-3-sulfonamides 优时比制药有限公司 2022-12-20 — — CN claimed
US-11345662-B2 Aza (indole)-, benzothiophene-, and benzofuran-3-sulfonamides UCB PHARMA GMBH (DE) 2022-05-31 — — US claimed
US-20220048858-A1 Aza (Indole)-, Benzothiophene-, And Benzofuran-3-Sulfonamides UCB PHARMA GMBH (DE) 2022-02-17 — — US claimed
US-20190345104-A1 Aza (Indole)-, Benzothiophene-, And Benzofuran-3-Sulfonamides UCB PHARMA GMBH (DE) 2019-11-14 — — US claimed
US-12071404-B2 Aza (indole)-, benzothiophene-, and benzofuran-3-sulfonamides UCB PHARMA GMBH (DE) 2024-08-27 — — US disclosed
US-11820746-B2 Aza (indole)-, benzothiophene-, and benzofuran-3-sulfonamides UCB PHARMA GMBH (DE) 2023-11-21 — — US disclosed
US-20230348384-A1 Aza (Indole)-, Benzothiophene-, And Benzofuran-3-Sulfonamides UCB PHARMA GMBH (DE) 2023-11-02 — — US 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
US-11345662-B2 Aza (indole)-, benzothiophene-, and benzofuran-3-sulfonamides UCB PHARMA GMBH (DE) 2022-05-31 — — US disclosed
US-20220127227-A1 Aza (Indole)-, Benzothiophene-, And Benzofuran-3-Sulfonamides UCB PHARMA GMBH (DE) 2022-04-28 — — US disclosed
US-20190345104-A1 Aza (Indole)-, Benzothiophene-, And Benzofuran-3-Sulfonamides UCB PHARMA GMBH (DE) 2019-11-14 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220127227-A1 Aza (Indole)-, Benzothiophene-, And Benzofuran-3-Sulfonamides GPR17, GPR18, GPR27 SGK1 3774/4885CYP2C9 3580/4885CYP2C19 1298/4885
US-11345662-B2 Aza (indole)-, benzothiophene-, and benzofuran-3-sulfonamides GPR17, GPR18, GPR27 SGK1 3774/4885CYP2C9 3580/4885CYP2C19 1298/4885
US-11820746-B2 Aza (indole)-, benzothiophene-, and benzofuran-3-sulfonamides GPR17, GPR18, GPR27 SGK1 3774/4885CYP2C9 3580/4885CYP2C19 1298/4885
US-20220048858-A1 Aza (Indole)-, Benzothiophene-, And Benzofuran-3-Sulfonamides GPR17, GPR18, GPR27 SGK1 3774/4885CYP2C9 3580/4885CYP2C19 1298/4885
US-20230348384-A1 Aza (Indole)-, Benzothiophene-, And Benzofuran-3-Sulfonamides GPR17, GPR18, GPR27 SGK1 3774/4885CYP2C9 3580/4885CYP2C19 1298/4885
US-12071404-B2 Aza (indole)-, benzothiophene-, and benzofuran-3-sulfonamides GPR17, GPR18, GPR27 SGK1 3774/4885CYP2C9 3580/4885CYP2C19 1298/4885
US-20190345104-A1 Aza (Indole)-, Benzothiophene-, And Benzofuran-3-Sulfonamides GPR17, GPR18, GPR27 SGK1 3774/4885CYP2C9 3580/4885CYP2C19 1298/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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