Omeprazole

Omeprazole

SCHEMBL6320176

COc1ccc2nc([S+]([O-])Cc3ncc(C)c(OC)c3C)[nH]c2c1.[Na]

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ATP4AATP4B

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATP4A known ✓ P20648 6/20 0.59
ATP4B known ✓ P51164 6/20 0.59
BRS3 P32247 2/20 0.61
CYP2C9 P11712 5/20 0.59
ATP1A1 P05023 5/20 0.59
ATP1B1 P05026 5/20 0.59
ATP1A3 P13637 5/20 0.59
ATP1B2 P14415 5/20 0.59
ATP1A2 P50993 5/20 0.59
ATP1B3 P54709 5/20 0.59
FXYD2 P54710 5/20 0.59
ATP1A4 Q13733 5/20 0.59
KMT2A Q03164 4/20 0.59
CYP1A2 P05177 4/20 0.59
CYP3A4 P08684 4/20 0.59
CYP2C19 P33261 4/20 0.59
WDR5 P61964 3/20 0.59
HTT P42858 2/20 0.59
DDAH1 O94760 2/20 0.59
ENGASE Q8NFI3 2/20 0.59

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
Esomeprazole SCHEMBL19535 0.99 BRS3 (0.62) BRS3ATP4AATP4BCYP2C9ATP1A1
Omeprazole SCHEMBL28256108 0.99 BRS3 (0.62) BRS3ATP4AATP4BCYP2C9ATP1A1
Esomeprazole SCHEMBL29691369 0.99 BRS3 (0.62) BRS3ATP4AATP4BCYP2C9ATP1A1
Omeprazole SCHEMBL29772327 0.99 BRS3 (0.62) BRS3ATP4AATP4BCYP2C9ATP1A1
Omeprazole SCHEMBL140006 0.99 BRS3 (0.62) BRS3ATP4AATP4BCYP2C9ATP1A1
Omeprazole SCHEMBL1192 0.99 BRS3 (0.62) BRS3ATP4AATP4BCYP2C9ATP1A1
Esomeprazole SCHEMBL30426884 0.99 BRS3 (0.62) BRS3ATP4AATP4BCYP2C9ATP1A1
Omeprazole SCHEMBL29360040 0.99 BRS3 (0.62) BRS3ATP4AATP4BCYP2C9ATP1A1
Omeprazole SCHEMBL589808 0.98 BRS3 (0.61) BRS3ATP4AATP4BCYP2C9ATP1A1
Omeprazole SCHEMBL2516731 0.98 BRS3 (0.61) BRS3ATP4AATP4BCYP2C9ATP1A1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1595879-A2 Alkoxy substituted benzimidazole compounds, pharmaceutical preparations containing the same, and methods of using the same aaiPharma Inc. (US) 2005-11-16 EP disclosed
EP-1206466-B1 ALKOXY SUBSTITUTED BENZIMIDAZOLE COMPOUNDS, PHARMACEUTICAL PREPARATIONS CONTAINING THE SAME, AND METHODS OF USING THE SAME AAIPHARMA INC (US) 2005-10-12 EP disclosed
US-20040157887-A1 Alkoxy substituted benzimidazole compounds, pharmaceutical preparations containing the same, and methods of using the same WELLS FARGO BANK, N.A. 2004-08-12 US disclosed
US-6706737-B2 INHIBITING GASTRIC ACID SECRETION ARE KNOWN IN THE ART AND INCLUDE A CLASS OF BENZIMIDAZOLE- SUBSTITUTED COMPOUNDS, ONE OF WHICH IS OMEPRAZOLE AAIPHARMA SERVICES CORP. 2004-03-16 US disclosed
US-6667321-B2 Used in inhibiting gastric acid secretion REGIONS BANK 2003-12-23 US disclosed
US-6667324-B1 Omeprazole with its positional isomer and diastereomers; gastric acid related diseases REGIONS BANK 2003-12-23 US disclosed
US-6667323-B1 Omeprazole with its positional isomer and diastereomers REGIONS BANK 2003-12-23 US disclosed
US-20030225136-A1 Alkoxy substituted benzimidazole compounds, pharmaceutical preparations containing the same, and methods of using the same AAIPHARMA SERVICES CORP. 2003-12-04 US disclosed
US-20030225135-A1 DRY-BLEND PHARMACEUTICAL FORMULATIONS AAIPHARMA SERVICES CORP. 2003-12-04 US disclosed
US-20030225137-A1 DRY BLEND PHARMACEUTICAL FORMULATIONS AAIPHARMA SERVICES CORP. 2003-12-04 US disclosed
EP-1206466-A1 ALKOXY SUBSTITUTED BENZIMIDAZOLE COMPOUNDS, PHARMACEUTICAL PREPARATIONS CONTAINING THE SAME, AND METHODS OF USING THE SAME aaiPharma Inc. (US) 2002-05-22 EP disclosed
US-6369087-B1 Alkoxy substituted benzimidazole compounds, pharmaceutical preparations containing the same, and methods of using the same ALCAMI CAROLINAS CORPORATION 2002-04-09 US disclosed
US-6326384-B1 CONTAINING 6-METHOXY-2-(((4-METHOXY-3,5-DIMETHYL-2-PYRIDINYL)METHYL)-SULF INYL)-1H-BENZIMIDAZOLE; ORAL ADMINISTERING ALCAMI CAROLINAS CORPORATION 2001-12-04 US disclosed
US-6316020-B1 Pharmaceutical formulations AAIPHARMA SERVICES CORP. 2001-11-13 US disclosed
US-6312723-B1 COMPOUNDS USED IN INHIBITING GASTRIC ACID SECRETION 6-METHOXY-2-(((4-METHOXY-3, 5-DIMETHYL-2-PYRIDINYL)METHYL)SULFINYL)-1H-BENZIMIDAZOLE IN TABLET OR CAPSULE FORM WITH CYCLODEXTRIN AAIPHARMA SERVICES CORP. 2001-11-06 US disclosed
US-6312712-B1 Method of improving bioavailability AAIPHARMA SERVICES CORP. 2001-11-06 US disclosed
US-6268385-B1 6-METHOXY-2-(((4-METHOXY-3, 5-DIMETHYL-2-PYRIDINYL)METHYL)SULFINYL)-1H-BENZIMIDAZOLE; TREATING GASTRIC ACID RELATED DISEASES IN MAMMALS REGIONS BANK 2001-07-31 US disclosed
US-6262086-B1 6-METHOXY-2-(((4-METHOXY-3, 5-DIMETHYL-2-PYRIDINYL)METHYL)SULFINYL)-1H-BENZIMIDAZOLE; ANTISECRETORY AGENTS REGIONS BANK 2001-07-17 US disclosed
US-6262085-B1 TREATING GASTRIC ACID RELATED DISEASES IN MAMMALS ALCAMI CAROLINAS CORPORATION 2001-07-17 US disclosed
WO-2001014367-A1 ALKOXY SUBSTITUTED BENZIMIDAZOLE COMPOUNDS, PHARMACEUTICAL PREPARATIONS CONTAINING THE SAME, AND METHODS OF USING THE SAME APPLIED ANALYTICAL INDUSTRIES, INC. (US) 2001-03-01 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 (4 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-20030225137-A1 DRY BLEND PHARMACEUTICAL FORMULATIONS CYP2D6, CYP2C19, CYP2B6 ATP4A 2699/4885ATP4B 1510/4885BRS3 563/4885
US-20040157887-A1 Alkoxy substituted benzimidazole compounds, pharmaceutical preparations containing the same, and methods of using the same CYP2C19, CYP3A5, CYP3A4 ATP4A 1549/4885ATP4B 876/4885BRS3 695/4885
US-20030225135-A1 DRY-BLEND PHARMACEUTICAL FORMULATIONS CYP2C19, CYP2D6, CYP2C9 ATP4A 2784/4885ATP4B 1648/4885BRS3 615/4885
US-20030225136-A1 Alkoxy substituted benzimidazole compounds, pharmaceutical preparations containing the same, and methods of using the same CYP2C19, CYP3A5, CYP3A4 ATP4A 1549/4885ATP4B 876/4885BRS3 695/4885

“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.