SCHEMBL6159360

SCHEMBL6159360

Cc1ccc(NC(=O)c2nc(C34CCC(CC3)CC4)[nH]c2COC23CC4CC(CC(C4)C2)C3)cc1C(=O)O

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 1/20 0.54

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
SCHEMBL6158968 0.90 CCKBR (0.54) CCKBR
SCHEMBL6161350 0.89 CCKBR (0.54) CCKBR
SCHEMBL6158581 0.88 CCKBR (0.50) CCKBR
SCHEMBL6162627 0.85 CCKBR (0.49) CCKBR
SCHEMBL6161021 0.85 CCKBR (0.74) CCKBR
SCHEMBL6168427 0.85 CCKBR (0.74) CCKBR
SCHEMBL6160691 0.85 CCKBR (0.60) CCKBR
SCHEMBL6159718 0.85 CCKBR (0.74) CCKBR
SCHEMBL6161003 0.85 CCKBR (0.73) CCKBR
SCHEMBL6163793 0.84 CCKBR (0.50) 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