SCHEMBL7688538

SCHEMBL7688538

CN1CCC[C@H]1c1nc(C(=O)Nc2cccc(C(=O)OCc3ccccc3)c2)c(CCC23CC4CC(CC(C4)C2)C3)[nH]1

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 1/20 0.51

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
SCHEMBL7688542 1.00 CCKBR (0.51) CCKBR
SCHEMBL6161783 0.89 CCKBR (0.58) CCKBR
SCHEMBL6159967 0.89 CCKBR (0.58) CCKBR
SCHEMBL6159977 0.89 CCKBR (0.58) CCKBR
SCHEMBL6160147 0.87 CCKBR (0.60) CCKBR
SCHEMBL6163512 0.86 CCKBR (0.52) CCKBR
SCHEMBL6160397 0.86 CCKBR (0.52) CCKBR
SCHEMBL6163521 0.86 CCKBR (0.52) CCKBR
SCHEMBL6159673 0.85 CCKBR (0.53) CCKBR
SCHEMBL6158535 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6479531-B1 Gastrin and cholecystokinin receptor ligands JAMES BLACK FOUNDATION LIMITED (GB) 2002-11-12 US disclosed