SCHEMBL30716871

SCHEMBL30716871

CC(=O)Nc1cccc(C(=O)N[C@@H](CCCCN)C(=O)COc2c(F)cccc2F)c1

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.58
CTSH P09668 2/20 0.58
CTSL P07711 2/20 0.48
CTSB P07858 1/20 0.48
CTSS P25774 1/20 0.48

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
SCHEMBL19983211 1.00 CTSK (0.58) CTSKCTSHCTSLCTSBCTSS
SCHEMBL19982990 1.00 CTSK (0.58) CTSKCTSHCTSLCTSBCTSS
SCHEMBL25658892 1.00 CTSK (0.58) CTSKCTSHCTSLCTSBCTSS
SCHEMBL21113120 0.94 CTSK (0.55) CTSKCTSHCTSLCTSBCTSS
SCHEMBL25658902 0.92 CTSK (0.48) CTSKCTSH
SCHEMBL25659391 0.88 CTSK (0.45) CTSKCTSHCTSLCTSBCTSS
SCHEMBL25659477 0.88 CTSK (0.45) CTSKCTSHCTSLCTSBCTSS
SCHEMBL19972742 0.86 CTSK (0.64) CTSKCTSHCTSLCTSBCTSS
SCHEMBL19972743 0.86 CTSK (0.64) CTSKCTSHCTSLCTSBCTSS
SCHEMBL19983311 0.85 CA1 (0.51) CTSKCTSH

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
CN-109983012-B Ketone inhibitors of lysine gum protease 莱特豪斯制药公司 2023-12-01 CN disclosed