SCHEMBL7810909

SCHEMBL7810909

CO[C@H]1CC(S(=O)(=O)c2ccc(-c3ccc(S(C)(=O)=O)cc3)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 19/20 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
SCHEMBL1139295 1.00 CTSS (0.50) CTSS
SCHEMBL1139344 1.00 CTSS (0.50) CTSS
SCHEMBL1139312 0.93 CTSS (0.49) CTSS
SCHEMBL1139665 0.93 CTSS (0.49) CTSS
SCHEMBL12855879 0.92 CTSS (0.51) CTSS
SCHEMBL1139432 0.92 CTSS (0.52) CTSS
SCHEMBL1139887 0.92 CTSS (0.51) CTSS
SCHEMBL1140013 0.92 CTSS (0.51) CTSS
SCHEMBL1139362 0.92 CTSS (0.52) CTSS
SCHEMBL1139124 0.91 CTSS (0.49) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2440521-B1 NOVEL CYCLOPENTANE DERIVATIVES HOFFMANN LA ROCHE (CH) 2014-04-30 EP disclosed
WO-2010142650-A1 NOVEL CYCLOPENTANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2010-12-16 WO disclosed