SCHEMBL6048166

SCHEMBL6048166

CC(C)(C)OC(=O)NC[C@H](C(=O)N(C#N)C1CC1)[Si](C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 10/20 0.38
CTSS P25774 8/20 0.38
CTSL P07711 3/20 0.35
CTSB P07858 2/20 0.35
CTSD P07339 1/20 0.34
EPHX1 P07099 1/20 0.34
GFER P55789 1/20 0.34
DPP4 P27487 1/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL5606158 0.77 CTSK (0.38) CTSKCTSSCTSLCTSBEPHX1
SCHEMBL5606156 0.77 CTSK (0.38) CTSKCTSSCTSLCTSBEPHX1
SCHEMBL6048161 0.76 CTSS (0.46) CTSKCTSSCTSLCTSB
SCHEMBL5581496 0.74 HTT (0.42) CTSKCTSSCTSLCTSBCTSD
SCHEMBL6660147 0.73 CTSS (0.47) CTSKCTSSCTSLCTSBKMT2A
SCHEMBL5696946 0.71 DPP4 (0.35) CTSKCTSSCTSLCTSBCTSD
SCHEMBL6660154 0.70 EPHX1 (0.40) CTSKCTSSCTSLCTSBCTSD
SCHEMBL6657069 0.69 CTSS (0.48) CTSKCTSSCTSLCTSB
SCHEMBL28272670 0.68 SERPINE1 (0.43) CTSKCTSSMEN1GAAKMT2A
SCHEMBL14167278 0.67 CTSK (0.45) CTSKCTSSCTSLCTSBEPHX1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1716158-A2 SILINANE COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS Schering Aktiengesellschaft (DE) 2006-11-02 EP disclosed
WO-2005074904-A2 SILINANE COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2005-08-18 WO disclosed