SCHEMBL7004162

SCHEMBL7004162

F[C](F)C(F)=Cc1ncco1

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
SCHEMBL31540744 0.76
SCHEMBL30673565 0.73 POLB (0.37)
SCHEMBL30673547 0.73 POLB (0.37)
SCHEMBL9111365 0.71
SCHEMBL9111358 0.71
SCHEMBL15870902 0.69
SCHEMBL7704419 0.69
SCHEMBL55240 0.66
SCHEMBL87629 0.66
SCHEMBL289070 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040234594-A1 Pharmaceutical formulation and process LUNDBERG PER JOHAN (SE) 2004-11-25 US claimed
US-20020086029-A1 Pharmaceutical formulation and process ASTRAZENECA AB. 2002-07-04 US claimed
US-20020012676-A1 NEW PHARMACEUTICAL FORMULATION AND PROCESS ASTRAZENECA AB (SE) 2002-01-31 US claimed
US-20020086029-A1 Pharmaceutical formulation and process ASTRAZENECA AB. 2002-07-04 US disclosed
US-6013281-A FORMING A CORE MATERIAL COMPRISING A PROTON PUMP INHIBITOR AND AN ALKALINE REACTING COMPOUND, APPLYING AN ENTERIC POLYMER LAYER TO SURROUND THE CORE THEREBY FORMING IN SITU A SEPARATING LAYER AS A SALT OF POLYMER AND ALKALINE COMPOUND ASTRA AKTIEBOLAG (SE) 2000-01-11 US disclosed