SCHEMBL6161149

SCHEMBL6161149

O=C(O)c1cccc(NC(=O)c2nc(C3CCC=CCC3)[nH]c2COC23CC4CC(CC(C4)C2)C3)c1

nearest known ligand 0.86

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 1/20 0.86

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
SCHEMBL6160887 0.92 CCKBR (1.00) CCKBR
SCHEMBL6160905 0.92 CCKBR (1.00) CCKBR
SCHEMBL6159682 0.92 CCKBR (1.00) CCKBR
SCHEMBL6159592 0.92 CCKBR (0.73) CCKBR
SCHEMBL6159562 0.91 CCKBR (0.85) CCKBR
SCHEMBL6159346 0.89 CCKBR (0.81) CCKBR
SCHEMBL6159940 0.87 CCKBR (0.79) CCKBR
SCHEMBL6158711 0.86 CCKBR (0.77) CCKBR
SCHEMBL6159683 0.86 CCKBR (0.77) CCKBR
SCHEMBL6160495 0.85 CCKBR (0.64) CCKBR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1178969-B1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS BLACK JAMES FOUNDATION (GB) 2005-07-13 EP disclosed
US-6479531-B1 Gastrin and cholecystokinin receptor ligands JAMES BLACK FOUNDATION LIMITED (GB) 2002-11-12 US disclosed