SCHEMBL8283263

SCHEMBL8283263

O=C(N[C@@H]1C(=O)CO[C@H]1CCF)[C@H](CC1CCCCC1)NC(=O)N1CCOCC1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSS P25774 20/20 0.54
CTSL P07711 15/20 0.51
CTSB P07858 3/20 0.49
CTSK P43235 10/20 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
SCHEMBL8283848 1.00 CTSS (0.54) CTSSCTSLCTSBCTSK
SCHEMBL8283433 1.00 CTSS (0.54) CTSSCTSLCTSBCTSK
SCHEMBL8282469 0.93 CTSS (0.54) CTSSCTSLCTSBCTSK
SCHEMBL8283269 0.93 CTSS (0.54) CTSSCTSLCTSBCTSK
SCHEMBL6515007 0.91 CTSS (0.58) CTSSCTSLCTSBCTSK
SCHEMBL8283441 0.86 CTSS (0.56) CTSSCTSLCTSBCTSK
SCHEMBL8283434 0.86 CTSS (0.56) CTSSCTSLCTSBCTSK
SCHEMBL6509199 0.80 CTSS (0.52) CTSSCTSLCTSBCTSK
SCHEMBL8283266 0.80 CTSS (0.52) CTSSCTSLCTSBCTSK
SCHEMBL8265543 0.74 CTSL (0.57) CTSSCTSLCTSK

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
WO-2005082876-A1 C-5 SUBSTITUTED FURANONE DIPEPTIDE CATHEPSIN S INHIBITORS MEDIVIR UK LTD (GB) 2005-09-09 WO disclosed