SCHEMBL4607165

SCHEMBL4607165

CS(=O)(=O)N1CCc2c(c(-c3ccc(Cl)c(CNC(=O)c4ccccc4)c3)nn2CCCN2CCN(c3cccc(Cl)c3)CC2)C1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSS P25774 20/20 0.62

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
SCHEMBL4094303 0.91 CTSS (0.69) CTSS
SCHEMBL4090070 0.90 CTSS (0.57) CTSS
SCHEMBL4607286 0.87 CTSS (0.55) CTSS
SCHEMBL4086122 0.87 CTSS (0.61) CTSS
SCHEMBL4089976 0.85 CTSS (0.56) CTSS
SCHEMBL4084621 0.85 CTSS (0.61) CTSS
SCHEMBL4089818 0.85 CTSS (0.61) CTSS
SCHEMBL4094306 0.84 CTSS (0.60) CTSS
SCHEMBL4095642 0.84 CTSS (0.55) CTSS
SCHEMBL4086087 0.84 CTSS (0.60) CTSS

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-2008100620-A2 BICYCLIC AMINOPROPYL TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S SUNESIS PHARMACEUTICALS, INC. (US) 2008-08-21 WO disclosed