SCHEMBL1812877

SCHEMBL1812877

COCCOC(=O)Nc1cccc(C)c1CNc1cccn2c(C)c(C)nc12

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 19/20 0.60
CYP2C9 P11712 19/20 0.60
CYP2D6 P10635 11/20 0.60
CYP2C19 P33261 9/20 0.60
CYP1A2 P05177 8/20 0.60

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
Pumaprazole SCHEMBL29493303 0.91 CYP3A4 (0.69) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
Pumaprazole SCHEMBL451376 0.91 CYP3A4 (0.69) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL1816224 0.91 CYP3A4 (0.48) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL8892144 0.91 CYP3A4 (0.48) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL7503350 0.90 CYP3A4 (0.60) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL1812546 0.90 CYP3A4 (0.68) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
Hydrochloric Acid SCHEMBL8804655 0.90 CYP3A4 (0.59) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL7828059 0.89 CYP3A4 (0.47) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL6379573 0.89 CYP3A4 (0.58) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL6379721 0.88 CYP3A4 (0.57) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0841904-B1 ORAL PHARMACEUTICAL COMPOSITIONS WITH DELAYED RELEASE OF REVERSIBLE PROTON PUMP INHIBITORS ALTANA PHARMA AG (DE) 2003-02-05 EP claimed
EP-0723544-B1 ALKOXY ALKYL CARBAMATES OF IMIDAZO[1,2-a]PYRIDINES BYK GULDEN LOMBERG CHEM FAB (DE) 2001-04-18 EP claimed
US-6132768-A FOR TREATING DISORDERS CAUSED BY HELICOBACTER BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2000-10-17 US claimed
EP-0841904-A1 ORAL PHARMACEUTICAL COMPOSITIONS WITH DELAYED RELEASE OF REVERSIBLE PROTON PUMP INHIBITORS Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1998-05-20 EP claimed
US-5719161-A REACTING AN IMIDAZO(1,2-A)PYRIDINE WITH A PHENYLCARBAMATE; USEFUL IN THE TREATMENT OF GASTROINTESTINAL DISEASES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1998-02-17 US claimed
WO-1997002021-A1 ORAL PHARMACEUTICAL COMPOSITIONS WITH DELAYED RELEASE OF REVERSIBLE PROTON PUMP INHIBITORS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1997-01-23 WO claimed
US-7951398-B2 Pharmaceutical preparation comprising an active dispersed on a matrix NYCOMED GMBH (DE) 2011-05-31 US disclosed
US-20090048287-A1 Compositions useful for treating gastrointestinal motility disorders EDUSA PHARMACEUTICALS, INC. 2009-02-19 US disclosed
US-20070122474-A1 Pharmaceutical preparation comprising an active dispersed on a matrix ALTANA PHARMA AG 2007-05-31 US disclosed
US-7175854-B2 Pharmaceutical preparation comprising an active dispersed on a matrix ALTANA PHARMA AG (DE) 2007-02-13 US disclosed
US-20060189648-A1 Compositions useful for increasing lower esophageal sphincter pressure EDUSA PHARMACEUTICALS, INC. 2006-08-24 US disclosed
EP-1663313-A2 COMPOSITIONS USEFUL FOR TREATING GASTROINTESTINAL MOTILITY DISORDERS Dynogen Pharmaceuticals Inc. (US) 2006-06-07 EP disclosed
US-20050059704-A1 Compositions useful for treating gastrointestinal motility disorders DYNOGEN PHARMACEUTICALS, INC. (US) 2005-03-17 US disclosed
EP-0841904-B1 ORAL PHARMACEUTICAL COMPOSITIONS WITH DELAYED RELEASE OF REVERSIBLE PROTON PUMP INHIBITORS ALTANA PHARMA AG (DE) 2003-02-05 EP disclosed
WO-2002045693-A1 PHARMACEUTICAL PREPARATION COMPRISING AN ACTIVE DISPERSED ON A MATRIX ALTANA PHARMA AG (DE) 2002-06-13 WO disclosed
EP-0723544-B1 ALKOXY ALKYL CARBAMATES OF IMIDAZO[1,2-a]PYRIDINES BYK GULDEN LOMBERG CHEM FAB (DE) 2001-04-18 EP disclosed
US-6132768-A FOR TREATING DISORDERS CAUSED BY HELICOBACTER BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2000-10-17 US disclosed
US-5719161-A REACTING AN IMIDAZO(1,2-A)PYRIDINE WITH A PHENYLCARBAMATE; USEFUL IN THE TREATMENT OF GASTROINTESTINAL DISEASES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1998-02-17 US disclosed
EP-0723544-A1 ALKOXY ALKYL CARBAMATES FROM IMIDAZO (1,2-a)PYRIDINES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1996-07-31 EP disclosed
WO-1995010518-A1 ALKOXY ALKYL CARBAMATES FROM IMIDAZO (1,2-a)PYRIDINES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1995-04-20 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-20090048287-A1 Compositions useful for treating gastrointestinal motility disorders HRH2, MLNR, HTR3A CYP3A4 1306/4885CYP2C9 1083/4885CYP2D6 620/4885
US-20050059704-A1 Compositions useful for treating gastrointestinal motility disorders HRH2, MLNR, HTR3A CYP3A4 1306/4885CYP2C9 1083/4885CYP2D6 620/4885
US-20060189648-A1 Compositions useful for increasing lower esophageal sphincter pressure HTR3A, HTR3D, HTR3B CYP3A4 2764/4885CYP2C9 2333/4885CYP2D6 2330/4885

“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.