SCHEMBL4574190

SCHEMBL4574190

CS(=O)(=O)N1CCc2c(c(-c3ccc(C(F)(F)F)c(CN)c3)nn2CC(O)CN2CCC(c3nc(=O)[nH][nH]3)CC2)C1

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSS P25774 20/20 0.60

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
SCHEMBL4572805 0.90 CTSS (0.58) CTSS
SCHEMBL4085399 0.88 CTSS (0.53) CTSS
SCHEMBL4084584 0.87 CTSS (0.77) CTSS
SCHEMBL4572754 0.84 CTSS (0.60) CTSS
SCHEMBL4572786 0.84 CTSS (0.76) CTSS
SCHEMBL4094157 0.79 CTSS (0.62) CTSS
SCHEMBL8159762 0.78 CTSS (0.57) CTSS
SCHEMBL4091533 0.78 CTSS (0.53) CTSS
SCHEMBL4090656 0.78 CTSS (0.69) CTSS
SCHEMBL13849736 0.77 CTSS (0.74) 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-2008100635-A1 1- [3- (MONOCYCLIC AMINO) PROPYL] - 4, 5, 6, 7-TETRAHYDRO-1H-PYRAZOLO [4, 3-C] -PYRIDINES AS MODULATORS OF CATHEPSIN S SUNESIS PHARMACEUTICALS, INC. (US) 2008-08-21 WO disclosed