SCHEMBL4608276

SCHEMBL4608276

CCN1CCc2c(c(-c3ccc(C(F)(F)F)c(SCC(=O)N4CCCC4)c3)nn2CC(O)CN2CCN(c3cccc(O)c3)CC2)C1

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSS P25774 20/20 0.71

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
SCHEMBL4534581 0.91 CTSS (0.72) CTSS
SCHEMBL4528509 0.90 CTSS (0.75) CTSS
SCHEMBL4608306 0.88 CTSS (0.71) CTSS
SCHEMBL4524670 0.85 CTSS (0.78) CTSS
SCHEMBL4522008 0.83 CTSS (1.00) CTSS
SCHEMBL4527905 0.82 CTSS (0.77) CTSS
SCHEMBL4538039 0.82 CTSS (0.89) CTSS
SCHEMBL4534092 0.81 CTSS (0.77) CTSS
SCHEMBL4538203 0.80 CTSS (0.82) CTSS
SCHEMBL4522349 0.80 CTSS (0.82) 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