SCHEMBL14200434

SCHEMBL14200434

CCCCCS(=O)(=O)N(CCC(C)(C)C)CC(C)C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.33
CNR2 P34972 1/20 0.33
FAAH O00519 2/20 0.32
CES1 P23141 4/20 0.31
MMP3 P08254 1/20 0.30

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
SCHEMBL14200427 0.98 CA2 (0.36) CA2CNR2FAAHCES1MMP3
SCHEMBL14200430 0.95 CNR2 (0.33) CNR2MMP3
SCHEMBL14228928 0.85 CNR2 (0.39) CA2CNR2FAAHCES1MMP3
SCHEMBL14200419 0.84 ALDH1A1 (0.30)
SCHEMBL14200354 0.83 CNR2 (0.38) CA2CNR2FAAHCES1
SCHEMBL14200353 0.83 CA1 (0.39) CA2CNR2FAAHCES1
SCHEMBL14200424 0.83
SCHEMBL14200364 0.83 CNR2 (0.38) CA2CNR2FAAHCES1
SCHEMBL14228930 0.83 CNR2 (0.41) CA2CNR2FAAHCES1MMP3
SCHEMBL14201184 0.83 CNR2 (0.32) CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7365093-B2 Endothelin antagonists ABBOTT LABORATORIES (US) 2008-04-29 US disclosed
US-7208517-B1 Endothelin antagonists ABBOTT LABORTORIES (US) 2007-04-24 US disclosed
US-7208517-B1 Endothelin antagonists ABBOTT LABORTORIES (US) 2007-04-24 US disclosed