SCHEMBL1813533

SCHEMBL1813533

COCCOC(=O)Nc1cccc(C)c1COc1cccn2c(C)c(C)nc12

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.64
CYP2C9 P11712 3/20 0.64
CYP1A2 P05177 2/20 0.64
CYP2D6 P10635 2/20 0.64
CYP2C19 P33261 2/20 0.64
GUCY1B2 O75343 11/20 0.45
GUCY1A2 P33402 11/20 0.45
GUCY1A1 Q02108 11/20 0.45
GUCY1B1 Q02153 11/20 0.45

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
SCHEMBL1817623 0.91 CYP3A4 (0.73) CYP3A4CYP2C9CYP1A2CYP2D6CYP2C19
SCHEMBL1818160 0.91 ATP4A (0.53) CYP3A4CYP2C9CYP1A2CYP2D6CYP2C19
SCHEMBL7839635 0.89 CYP1A2 (0.49) CYP3A4CYP2C9CYP1A2CYP2D6CYP2C19
SCHEMBL1813958 0.85 CYP3A4 (0.66) CYP3A4CYP2C9CYP1A2CYP2D6CYP2C19
SCHEMBL1812877 0.85 CYP3A4 (0.60) CYP3A4CYP2C9CYP1A2CYP2D6CYP2C19
SCHEMBL9097105 0.82 CYP1A2 (0.58) CYP3A4CYP2C9CYP1A2CYP2D6CYP2C19
SCHEMBL1814241 0.82 ATP4A (0.60) CYP3A4CYP2C9CYP1A2CYP2D6CYP2C19
SCHEMBL7499698 0.80 CYP1A2 (0.49) CYP3A4CYP2C9CYP1A2CYP2D6CYP2C19
SCHEMBL8137658 0.80 CYP1A2 (0.55) CYP3A4CYP2C9CYP1A2CYP2D6CYP2C19
SCHEMBL7499341 0.79 CYP3A4 (1.00) CYP3A4CYP2C9CYP1A2CYP2D6CYP2C19

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-0841904-B1 ORAL PHARMACEUTICAL COMPOSITIONS WITH DELAYED RELEASE OF REVERSIBLE PROTON PUMP INHIBITORS ALTANA PHARMA AG (DE) 2003-02-05 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
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-20070122474-A1 Pharmaceutical preparation comprising an active dispersed on a matrix ALTANA PHARMA AG 2007-05-31 US disclosed
EP-1341527-A1 PHARMACEUTICAL PREPARATION COMPRISING AN ACTIVE DISPERSED ON A MATRIX ALTANA Pharma AG (DE) 2003-09-10 EP 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
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