SCHEMBL7800618

SCHEMBL7800618

CO[C@@H]1CC(S(=O)(=O)c2ccc(-c3cncc(Cl)c3)cc2C(F)(F)F)C[C@H]1C(=O)NC1(C#N)CC1

nearest known ligand 0.50

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSS P25774 20/20 0.50

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
SCHEMBL1139290 1.00 CTSS (0.50) CTSS
SCHEMBL1139584 1.00 CTSS (0.50) CTSS
SCHEMBL1138634 0.92 CTSS (0.51) CTSS
SCHEMBL1139760 0.92 CTSS (0.51) CTSS
SCHEMBL1139139 0.92 CTSS (0.51) CTSS
SCHEMBL1139406 0.92 CTSS (0.51) CTSS
SCHEMBL1139809 0.91 CTSS (0.50) CTSS
SCHEMBL1139774 0.91 CTSS (0.50) CTSS
SCHEMBL7812998 0.91 CTSS (0.52) CTSS
SCHEMBL1139867 0.91 CTSS (0.52) 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-2010142650-A1 NOVEL CYCLOPENTANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2010-12-16 WO disclosed