SCHEMBL5656511

SCHEMBL5656511

C[PH](=O)OCCCN

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL11290049 0.80
SCHEMBL11322752 0.80
SCHEMBL7034692 0.80
SCHEMBL11326387 0.80
SCHEMBL11335027 0.80
SCHEMBL9910587 0.80
SCHEMBL2184363 0.79
SCHEMBL1337335 0.78 ODC1 (0.43)
SCHEMBL1711468 0.76
SCHEMBL17366114 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101001612-A Controlled release dosage forms for gamma aminobutyric acid receptor agonists IMPAX LABORATORIES INC (US) 2007-07-18 CN disclosed
EP-1401423-A4 METHOD OF TREATING GASTROESOPHAGEAL REFLUX DISEASE AND NOCTURNAL ACID BREAKTHROUGH DEPOMED DEV LTD (BM) 2006-08-16 EP disclosed
EP-1344524-B1 Reflux inhibitors ASTRAZENECA AB (SE) 2006-08-02 EP disclosed
CN-1200713-C New (aminopropyl) methylphosphinic acids ASTRAZENECA AB (SE) 2005-05-11 CN disclosed
EP-1401423-A1 METHOD OF TREATING GASTROESOPHAGEAL REFLUX DISEASE AND NOCTURNAL ACID BREAKTHROUGH Depomed Development, Ltd (GB) 2004-03-31 EP disclosed
EP-1344524-A1 Reflux inhibitors AstraZeneca AB (SE) 2003-09-17 EP disclosed
EP-0936906-B1 REFLUX INHIBITORS ASTRAZENECA AB (SE) 2003-09-10 EP disclosed
US-20030162754-A1 Use of GABA and GABAB agonists TUFTS UNIVERSITY 2003-08-28 US disclosed
CN-1413104-A New (aminopropyl) methylphosphinic acids ASTRAZENECA AB (SE) 2003-04-23 CN disclosed
US-20030031711-A1 Method of treating gastroesophageal reflux disease and nocturnal acid breakthrough ASSERTIO THERAPEUTICS, INC. 2003-02-13 US disclosed
WO-2002096404-A1 METHOD OF TREATING GASTROESOPHAGEAL REFLUX DISEASE AND NOCTURNAL ACID BREAKTHROUGH DEPOMED DEVELOPMENT LTD (GB) 2002-12-05 WO disclosed
US-6117908-A Use of GABAB receptor agonists as reflux inhibitors ASTRA AKTIEBOLAG (SE) 2000-09-12 US disclosed
EP-0936906-A1 REFLUX INHIBITORS Astra Aktiebolag (SE) 1999-08-25 EP disclosed
WO-1998011885-A1 REFLUX INHIBITORS ASTRA AKTIEBOLAG (SE) 1998-03-26 WO disclosed