SCHEMBL7654250

SCHEMBL7654250

N#CCNC(=O)C(CNC(=O)c1ccc(C(=O)c2ccccc2)cc1)S(=O)(=O)Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSL P07711 13/20 0.52
CTSS P25774 12/20 0.52
CTSK P43235 8/20 0.52
CTSB P07858 9/20 0.49
CTSV O60911 2/20 0.45

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
SCHEMBL6061910 0.95 CTSL (0.56) CTSLCTSSCTSKCTSBCTSV
SCHEMBL6741968 0.91 CTSL (0.54) CTSLCTSSCTSKCTSBCTSV
SCHEMBL6737517 0.88 CTSL (0.49) CTSLCTSSCTSKCTSBCTSV
SCHEMBL6741252 0.87 CTSL (0.51) CTSLCTSSCTSKCTSBCTSV
SCHEMBL7664695 0.87 ESRRG (0.52) CTSLCTSSCTSKCTSB
SCHEMBL7667375 0.87 CTSL (0.49) CTSLCTSSCTSKCTSBCTSV
SCHEMBL7666762 0.87 CTSL (0.48) CTSLCTSSCTSKCTSBCTSV
SCHEMBL7655925 0.87 CTSL (0.49) CTSLCTSSCTSKCTSB
SCHEMBL6737869 0.87 CTSL (0.48) CTSLCTSSCTSKCTSB
SCHEMBL6740671 0.87 CTSL (0.51) CTSLCTSSCTSKCTSBCTSV

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