SCHEMBL7656008

SCHEMBL7656008

N#CC1(NC(=O)C(CNC(=O)N2CCOCC2)S(=O)(=O)Cc2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSS P25774 18/20 0.47
CTSL P07711 8/20 0.47
CTSK P43235 7/20 0.47
CTSB P07858 6/20 0.47

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
SCHEMBL6744961 0.85 CTSS (0.48) CTSSCTSLCTSKCTSB
SCHEMBL6063314 0.84 CTSS (0.40) CTSSCTSLCTSKCTSB
SCHEMBL7656057 0.84 CTSS (0.40) CTSSCTSLCTSKCTSB
SCHEMBL6629207 0.82 CTSS (0.45) CTSSCTSLCTSKCTSB
SCHEMBL7656003 0.81 CTSS (0.55) CTSSCTSLCTSKCTSB
SCHEMBL7655999 0.81 CTSS (0.55) CTSSCTSLCTSKCTSB
SCHEMBL5955838 0.77 CTSS (0.60) CTSSCTSLCTSKCTSB
SCHEMBL6628713 0.77 CTSS (0.47) CTSSCTSLCTSKCTSB
SCHEMBL6628710 0.77 CTSS (0.47) CTSSCTSLCTSKCTSB
SCHEMBL6740690 0.75 CTSS (0.45) CTSSCTSLCTSKCTSB

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
US-6492362-B1 Compounds and compositions as cathepsin S inhibitors AXYS PHARMACEUTICALS, INC. 2002-12-10 US disclosed