Sebetralstat

Sebetralstat

SCHEMBL19668181

COCc1nn(Cc2ccc(Cn3ccccc3=O)cc2)cc1C(=O)NCc1nccc(OC)c1F.O=S(=O)(O)CCS(=O)(=O)O

nearest known ligand 0.90

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

DRD2

The experimentally established mechanism targets of Sebetralstat. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 20/20 0.90
▸ CYP3A4 P08684 1/20 0.70
▸ CYP2C8 P10632 1/20 0.70
▸ CYP2C9 P11712 1/20 0.70

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
Sebetralstat SCHEMBL22495499 0.96 KLKB1 (0.94) KLKB1CYP3A4CYP2C8CYP2C9
Sebetralstat SCHEMBL22495486 0.96 KLKB1 (0.94) KLKB1CYP3A4CYP2C8CYP2C9
Sebetralstat SCHEMBL17785421 0.95 KLKB1 (1.00) KLKB1CYP3A4CYP2C8CYP2C9
Sebetralstat SCHEMBL29619273 0.95 KLKB1 (1.00) KLKB1CYP3A4CYP2C8CYP2C9
Sebetralstat SCHEMBL22495449 0.94 KLKB1 (0.98) KLKB1CYP3A4CYP2C8CYP2C9
Sebetralstat SCHEMBL28770013 0.94 KLKB1 (0.98) KLKB1CYP3A4CYP2C8CYP2C9
Sebetralstat SCHEMBL28769406 0.93 KLKB1 (0.88) KLKB1CYP3A4CYP2C8CYP2C9
Sebetralstat SCHEMBL19668205 0.93 KLKB1 (0.88) KLKB1CYP3A4CYP2C8CYP2C9
Sebetralstat SCHEMBL22495443 0.93 KLKB1 (0.95) KLKB1CYP3A4CYP2C8CYP2C9
Sebetralstat SCHEMBL22495502 0.91 KLKB1 (0.84) KLKB1CYP3A4CYP2C8CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4151630-A1 POLYMORPHS OF N-[(3-FLUORO-4-METHOXYPYRIDIN-2-YL)METHYL]-3-(METHOXYMETHYL)-1-({4-[2-OXOPYRIDIN-1-YL)METHYL]PHENYL}METHYL)PYRAZOLE-4-CARBOXAMIDE AS KALLIKREIN INHIBITORS Kalvista Pharmaceuticals Limited (GB) 2023-03-22 — — EP claimed
US-20240199573-A1 POLYMORPHS OF N-[(3-FLUORO-4-METHOXYPYRIDIN-2-YL)METHYL]-3-(METHOXYMETHYL)-1-({4-[(2-OXOPYRIDIN-1-YL)METHYL]PHENYL}METHYL)PYRAZOLE-4-CARBOXAMIDE AND SALTS THEREOF DRI UK LP (KY) 2024-06-20 — — US disclosed
US-11739068-B2 Polymorphs of N-[(3-fluoro-4-methoxypyridin-2-yl)methyl]-3-(methoxymethyl)-1-({4-[(2-oxopyridin-1-yl)methyl]phenyl}methyl)pyrazole-4-carboxamide and salts thereof KALVISTA PHARMACEUTICALS LIMITED (GB) 2023-08-29 — — US disclosed
EP-4151630-A1 POLYMORPHS OF N-[(3-FLUORO-4-METHOXYPYRIDIN-2-YL)METHYL]-3-(METHOXYMETHYL)-1-({4-[2-OXOPYRIDIN-1-YL)METHYL]PHENYL}METHYL)PYRAZOLE-4-CARBOXAMIDE AS KALLIKREIN INHIBITORS Kalvista Pharmaceuticals Limited (GB) 2023-03-22 — — EP disclosed
EP-3464265-B1 POLYMORPHS OF N-[(3-FLUORO-4-METHOXYPYRIDIN-2-YL)METHYL]-3-(METHOXYMETHYL)-1-({4-[2-OXOPYRIDIN-1-YL)METHYL]PHENYL}METHYL)PYRAZOLE-4-CARBOXAMIDE AS KALLIKREIN INHIBITORS KALVISTA PHARMACEUTICALS LTD (GB) 2022-07-13 — — EP disclosed
CN-109379891-B Polymorphs of a compound as kallikrein inhibitor 卡尔维斯塔制药有限公司 2022-04-26 — — CN disclosed
US-20220041571-A1 POLYMORPHS OF N-[(3-FLUORO-4-METHOXYPYRIDIN-2-YL)METHYL]-3-(METHOXYMETHYL)-1-({4-[(2-OXOPYRIDIN-1-YL)METHYL]PHENYL}METHYL)PYRAZOLE-4-CARBOXAMIDE AND SALTS THEREOF DRI UK LP (KY) 2022-02-10 — — US disclosed
US-11230537-B2 Polymorphs of n-[(3-fluoro-4-methoxypyridin-2-yl)methyl]-3-(methoxymethyl)-1-({4-[2-oxopyridin-1-yl)methyl]phenyl} methyl)pyrazole-4-carboxamide as iallikrein inhibitors KALVISTA PHARMACEUTICALS LIMITED (GB) 2022-01-25 — — US disclosed
US-20200317633-A1 POLYMORPHS OF N-[(3-FLUORO-4-METHOXYPYRIDIN-2-YL)METHYL]-3-(METHOXYMETHYL)-1 -({4-[2-OXOPYRIDIN-1-YL)METHYL]PHENYL} METHYL)PYRAZOLE-4-CARBOXAMIDE AS IALLIKREIN INHIBITORS DRI UK LP (KY) 2020-10-08 — — US disclosed
EP-3464265-A1 POLYMORPHS OF N-[(3-FLUORO-4-METHOXYPYRIDIN-2-YL)METHYL]-3-(METHOXYMETHYL)-1 -({4-[2-OXOPYRIDIN-1 -YL)METHYL]PHENYL} METHYL) PYRAZOLE -4-CARBOXAMIDE AS KALLIKREIN INHIBITORS Kalvista Pharmaceuticals Limited (GB) 2019-04-10 — — EP disclosed
WO-2017208005-A1 POLYMORPHS OF N-[(3-FLUORO-4-METHOXYPYRIDIN-2-YL)METHYL]-3-(METHOXYMETHYL)-1 -({4-[2-OXOPYRIDIN-1 -YL)METHYL]PHENYL} METHYL) PYRAZOLE -4-CARBOXAMIDE AS KALLIKREIN INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2017-12-07 — — WO 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 (5 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-11739068-B2 Polymorphs of N-[(3-fluoro-4-methoxypyridin-2-yl)methyl]-3-(methoxymethyl)-1-({4-[(2-oxopyridin-1-yl)methyl]phenyl}methyl)pyrazole-4-carboxamide and salts thereof CYP3A4, CYP4B1, TPMT KLKB1 4305/4885CYP3A4 1/4885CYP2C8 25/4885
US-20220041571-A1 POLYMORPHS OF N-[(3-FLUORO-4-METHOXYPYRIDIN-2-YL)METHYL]-3-(METHOXYMETHYL)-1-({4-[(2-OXOPYRIDIN-1-YL)METHYL]PHENYL}METHYL)PYRAZOLE-4-CARBOXAMIDE AND SALTS THEREOF CYP3A4, CYP4B1, TPMT KLKB1 4305/4885CYP3A4 1/4885CYP2C8 25/4885
US-20200317633-A1 POLYMORPHS OF N-[(3-FLUORO-4-METHOXYPYRIDIN-2-YL)METHYL]-3-(METHOXYMETHYL)-1 -({4-[2-OXOPYRIDIN-1-YL)METHYL]PHENYL} METHYL)PYRAZOLE-4-CARBOXAMIDE AS IALLIKREIN INHIBITORS KLKB1, KLK1, KLK5 KLKB1 1/4885CYP3A4 179/4885CYP2C8 366/4885
US-11230537-B2 Polymorphs of n-[(3-fluoro-4-methoxypyridin-2-yl)methyl]-3-(methoxymethyl)-1-({4-[2-oxopyridin-1-yl)methyl]phenyl} methyl)pyrazole-4-carboxamide as iallikrein inhibitors KLKB1, KLK1, KLK5 KLKB1 1/4885CYP3A4 141/4885CYP2C8 348/4885
US-20240199573-A1 POLYMORPHS OF N-[(3-FLUORO-4-METHOXYPYRIDIN-2-YL)METHYL]-3-(METHOXYMETHYL)-1-({4-[(2-OXOPYRIDIN-1-YL)METHYL]PHENYL}METHYL)PYRAZOLE-4-CARBOXAMIDE AND SALTS THEREOF CYP3A4, CYP4B1, TPMT KLKB1 4305/4885CYP3A4 1/4885CYP2C8 25/4885

“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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