SCHEMBL7659358

SCHEMBL7659358

N#CCNC(=O)C(CNC(=O)c1ccccc1)S(=O)(=O)Cc1cc(F)cc(F)c1F

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSL P07711 17/20 0.42
CTSS P25774 7/20 0.42
CTSB P07858 7/20 0.42
CTSK P43235 5/20 0.41
CTSV O60911 1/20 0.38

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
SCHEMBL6215306 0.89 CTSL (0.44) CTSLCTSSCTSBCTSKCTSV
SCHEMBL7663293 0.89 CTSL (0.44) CTSLCTSSCTSBCTSKCTSV
SCHEMBL7661877 0.88 CTSL (0.43) CTSLCTSSCTSBCTSKCTSV
SCHEMBL6740637 0.86 CTSL (0.46) CTSLCTSSCTSBCTSK
SCHEMBL7660654 0.86 CTSL (0.43) CTSLCTSSCTSBCTSKCTSV
SCHEMBL6742019 0.85 CTSL (0.42) CTSLCTSSCTSBCTSK
SCHEMBL7655925 0.83 CTSL (0.49) CTSLCTSSCTSBCTSK
SCHEMBL6063157 0.83 CTSL (0.43) CTSLCTSSCTSBCTSKCTSV
SCHEMBL6744442 0.82 CTSL (0.50) CTSLCTSSCTSBCTSKCTSV
SCHEMBL6061807 0.82 CTSL (0.46) CTSLCTSSCTSBCTSKCTSV

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