SCHEMBL7807983

SCHEMBL7807983

CC(C)(O[C@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CC1C(=O)NC1(C#N)CC1)c1ccc(Cl)cc1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSS P25774 16/20 0.59
CTSL P07711 8/20 0.59
CTSB P07858 3/20 0.59

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
SCHEMBL1139413 1.00 CTSS (0.59) CTSSCTSLCTSB
SCHEMBL15678435 1.00 CTSS (0.59) CTSSCTSLCTSB
SCHEMBL1139512 1.00 CTSS (0.59) CTSSCTSLCTSB
SCHEMBL1140192 0.94 CTSS (0.56) CTSSCTSLCTSB
SCHEMBL15678495 0.94 CTSS (0.56) CTSSCTSLCTSB
SCHEMBL7809627 0.94 CTSS (0.56) CTSSCTSLCTSB
SCHEMBL1139353 0.94 CTSS (0.56) CTSSCTSLCTSB
SCHEMBL1139248 0.86 CTSS (0.60) CTSSCTSLCTSB
SCHEMBL1139250 0.86 CTSS (0.60) CTSSCTSLCTSB
SCHEMBL1139724 0.84 CTSS (0.57) CTSSCTSLCTSB

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