SCHEMBL4574135

SCHEMBL4574135

CS(=O)(=O)N1CCc2c(c(-c3ccc(C(F)(F)F)c(SCC(=O)N4CCC(C(=O)O)CC4)c3)nn2CCCN2CCC(N3CCCC3=O)CC2)C1

nearest known ligand 0.90

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSS P25774 20/20 0.90

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
SCHEMBL4532081 0.95 CTSS (0.89) CTSS
SCHEMBL4531907 0.95 CTSS (1.00) CTSS
SCHEMBL4537229 0.94 CTSS (1.00) CTSS
SCHEMBL4528747 0.94 CTSS (0.93) CTSS
SCHEMBL4534988 0.94 CTSS (1.00) CTSS
SCHEMBL4536778 0.94 CTSS (1.00) CTSS
SCHEMBL4533277 0.94 CTSS (1.00) CTSS
SCHEMBL4517964 0.93 CTSS (1.00) CTSS
SCHEMBL4536397 0.93 CTSS (0.90) CTSS
SCHEMBL4530891 0.93 CTSS (0.93) 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-2008100621-A2 TETRAHYDRO-PYRAZOLO-PYRIDINE THIOETHER MODULATORS OF CATHEPSIN S SUNESIS PHARMACEUTICALS, INC. (US) 2008-08-21 WO claimed