SCHEMBL4787877

SCHEMBL4787877

O=C(c1ccc(Cl)cc1NS(=O)(=O)c1c(F)cccc1F)N1CCCC1

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 16/20 0.74

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
SCHEMBL14041933 0.99 CCKBR (0.77) CCKBR
SCHEMBL4750461 0.90 CCKBR (0.63) CCKBR
SCHEMBL4749841 0.85 CCKBR (1.00) CCKBR
SCHEMBL3745887 0.82 GRIK1 (0.56) CCKBR
SCHEMBL4787878 0.81 CCR2 (0.60) CCKBR
SCHEMBL4747136 0.77 CCKBR (0.80) CCKBR
SCHEMBL3078340 0.75 CCR2 (0.61)
SCHEMBL1381855 0.75 CCKBR (0.83) CCKBR
SCHEMBL13792026 0.75 CCKBR (1.00) CCKBR
SCHEMBL1383324 0.75 CCKBR (0.83) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008124524-A2 ARYL SULFONAMIDE COMPOUNDS AS MODULATORS OF THE CCK2 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2008-10-16 WO disclosed