SCHEMBL8575674

SCHEMBL8575674

CC(C)(C)OC(=O)NC(Cc1ccccc1)C(=O)Oc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSS P25774 8/20 0.59
CTSK P43235 7/20 0.59
CTSB P07858 2/20 0.59
CTSL P07711 1/20 0.59
EPHX2 P34913 1/20 0.57
ACE P12821 1/20 0.57
KLK5 Q9Y337 1/20 0.55
ATM Q13315 1/20 0.52
AKT1 P31749 1/20 0.52
REN P00797 2/20 0.50
PPARA Q07869 2/20 0.49
PPARG P37231 1/20 0.49
APP P05067 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
SCHEMBL7291961 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLEPHX2
SCHEMBL11022599 0.91 BCL2 (0.58) CTSSCTSKCTSBCTSLEPHX2
SCHEMBL8572724 0.88 REN (0.65) CTSSCTSKCTSBCTSLREN
SCHEMBL8572729 0.88 REN (0.65) CTSSCTSKCTSBCTSLREN
SCHEMBL11100198 0.87 ABCB1 (0.52) CTSSCTSKCTSBCTSLEPHX2
SCHEMBL11382926 0.87 CTSS (0.58) CTSSCTSKCTSBCTSLEPHX2
SCHEMBL11382927 0.87 CTSS (0.58) CTSSCTSKCTSBCTSLEPHX2
SCHEMBL28122853 0.86 CTSS (0.62) CTSSCTSKCTSBCTSLEPHX2
SCHEMBL28122855 0.86 CTSS (0.62) CTSSCTSKCTSBCTSLEPHX2
SCHEMBL16459752 0.86 CTSS (0.68) CTSSCTSKCTSBCTSLEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5853713-A Biologically compatible linear block copolymers of polyalkylene oxide and peptide units STERLING WINTHROP INC. (US) 1998-12-29 US disclosed
US-5618528-A Biologically compatible linear block copolymers of polyalkylene oxide and peptide units STERLING WINTHROP INC. (US) 1997-04-08 US disclosed
EP-0748226-A1 BLOCK COPOLYMERS NYCOMED IMAGING AS (NO) 1996-12-18 EP disclosed
WO-1995022991-A2 BLOCK COPOLYMERS NYCOMED IMAGING AS (NO) 1995-08-31 WO disclosed
US-5166136-A SPIROLACTAM CONTAINING PEPTIDES GLAXO GROUP LIMITED (GB) 1992-11-24 US disclosed
EP-0360390-A1 Spirolactam derivatives GLAXO GROUP LIMITED (GB) 1990-03-28 EP disclosed