Ufiprazole

Ufiprazole

SCHEMBL3170203

[2H]C([2H])([2H])Oc1c(C)cnc(CSc2nc3cc(OC)ccc3[nH]2)c1C

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRS3 P32247 3/20 0.74
CYP2C9 P11712 12/20 0.46
CYP2C19 P33261 11/20 0.46
CYP3A4 P08684 10/20 0.46
CYP1A2 P05177 9/20 0.46
KMT2A Q03164 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
WDR5 P61964 2/20 0.46
HTT P42858 2/20 0.46
KDM4E B2RXH2 1/20 0.46
DDAH1 O94760 1/20 0.46
ABCB11 O95342 1/20 0.46
ALDH1A1 P00352 1/20 0.46
ATP1A1 P05023 1/20 0.46
ATP1B1 P05026 1/20 0.46
CHRM2 P08172 1/20 0.46
ABCB1 P08183 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
MAPT P10636 1/20 0.46
CHRM1 P11229 1/20 0.46

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
Ufiprazole SCHEMBL3186458 0.98 BRS3 (0.71) BRS3CYP2C9CYP2C19CYP3A4CYP1A2
Ufiprazole SCHEMBL3180530 0.97 BRS3 (0.76) BRS3CYP2C9CYP2C19CYP3A4CYP1A2
Ufiprazole SCHEMBL662986 0.94 BRS3 (0.84) BRS3CYP2C9CYP2C19CYP3A4CYP1A2
Ufiprazole SCHEMBL29455226 0.94 BRS3 (0.84) BRS3CYP2C9CYP2C19CYP3A4CYP1A2
Ufiprazole SCHEMBL31529606 0.93 BRS3 (0.82) BRS3CYP2C9CYP2C19CYP3A4CYP1A2
Ufiprazole SCHEMBL7929368 0.93 BRS3 (0.82) BRS3CYP2C9CYP2C19CYP3A4CYP1A2
Ufiprazole SCHEMBL7950477 0.93 BRS3 (0.82) BRS3CYP2C9CYP2C19CYP3A4CYP1A2
Ufiprazole SCHEMBL13645507 0.91 BRS3 (0.62) BRS3CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL12873280 0.89 BRS3 (0.73) BRS3CYP2C9CYP2C19CYP3A4CYP1A2
Ufiprazole SCHEMBL13645485 0.89 BRS3 (0.58) BRS3CYP2C9CYP2C19CYP3A4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100010047-A1 Isotopically substituted proton pump inhibitors TAKEDA GMBH (DE) 2010-01-14 US claimed
US-20080146610-A1 2-Pyridinyl)methylsulfinyl]-1H-benzimidazole derivatives; substituents include methoxy and difluoromethoxy; at least one alkyl hydrogen is replaced by a deuterium atom: 5-difluoromethoxy-2-[(3-methoxy-4-monodeuteriomethoxy)-2-pyridinyl)methylsulfinyl]-1H-benzimidazole; gastrointestinal disorders NYCOMED GMBH (DE) 2008-06-19 US claimed
US-20100022779-A1 Isotopically substituted proton pump inhibitors NYCOMED GMBH (DE) 2010-01-28 US disclosed
US-20100010047-A1 Isotopically substituted proton pump inhibitors TAKEDA GMBH (DE) 2010-01-14 US disclosed
US-7601737-B2 2-Pyridinyl)methylsulfinyl]-1H-benzimidazole derivatives; substituents include methoxy and difluoromethoxy; at least one alkyl hydrogen is replaced by a deuterium atom: 5-difluoromethoxy-2-[(3-methoxy-4-monodeuteriomethoxy)-2-pyridinyl)methylsulfinyl]-1H-benzimidazole; gastrointestinal disorders NYCOMED GMBH (DE) 2009-10-13 US disclosed
US-20080146610-A1 2-Pyridinyl)methylsulfinyl]-1H-benzimidazole derivatives; substituents include methoxy and difluoromethoxy; at least one alkyl hydrogen is replaced by a deuterium atom: 5-difluoromethoxy-2-[(3-methoxy-4-monodeuteriomethoxy)-2-pyridinyl)methylsulfinyl]-1H-benzimidazole; gastrointestinal disorders NYCOMED GMBH (DE) 2008-06-19 US disclosed
EP-1910293-A1 ISOTOPICALLY SUBSTITUTED PROTON PUMP INHIBITORS Nycomed GmbH (DE) 2008-04-16 EP disclosed
WO-2007012650-A1 ISOTOPICALLY SUBSTITUTED PROTON PUMP INHIBITORS NYCOMED GMBH (DE) 2007-02-01 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 (3 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-20100022779-A1 Isotopically substituted proton pump inhibitors SLC10A2, ABCB11, SLC10A1 BRS3 218/4885CYP2C9 100/4885CYP2C19 24/4885
US-20080146610-A1 2-Pyridinyl)methylsulfinyl]-1H-benzimidazole derivatives; substituents include methoxy and difluoromethoxy; at least one alkyl hydrogen is replaced by a deuterium atom: 5-difluoromethoxy-2-[(3-methoxy-4-monodeuteriomethoxy)-2-pyridinyl)methylsulfinyl]-1H-benzimidazole; gastrointestinal disorders SLC10A2, CYP2J2, CYP2D6 BRS3 275/4885CYP2C9 81/4885CYP2C19 14/4885
US-20100010047-A1 Isotopically substituted proton pump inhibitors SLC10A2, ABCB11, SLC10A1 BRS3 218/4885CYP2C9 100/4885CYP2C19 24/4885

“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.