SCHEMBL8526669

SCHEMBL8526669

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C=O)CCC(N)=O

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSS P25774 6/20 0.57
CTSK P43235 5/20 0.57
CTSB P07858 2/20 0.57
CTSL P07711 1/20 0.57
REN P00797 5/20 0.54
ACE P12821 1/20 0.53
PLG P00747 1/20 0.51
AKT1 P31749 1/20 0.51
ATM Q13315 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
SCHEMBL8527574 0.93 REN (0.65) CTSSCTSKCTSBCTSLREN
SCHEMBL20204700 0.88 CTSS (0.65) CTSSCTSKCTSBCTSLREN
SCHEMBL28269148 0.88 CTSS (0.65) CTSSCTSKCTSBCTSLREN
SCHEMBL22962275 0.88 CTSS (0.65) CTSSCTSKCTSBCTSLREN
SCHEMBL20204705 0.88 CTSS (0.65) CTSSCTSKCTSBCTSLREN
SCHEMBL8584067 0.88 REN (0.58) REN
SCHEMBL7373235 0.84 CTSS (0.53) CTSSCTSKCTSBCTSLREN
SCHEMBL30091422 0.82 REN (0.62) CTSSCTSKCTSBCTSLREN
SCHEMBL29787480 0.82 CTSS (0.61) CTSSCTSKCTSBCTSLREN
SCHEMBL22962389 0.81 REN (0.75) CTSSCTSKCTSBCTSLREN

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-5821331-A INHIBIT THE PROTEOLYTIC ACTIVITY OF PROTEASES ELI LILLY AND COMPANY (US) 1998-10-13 US disclosed