SCHEMBL8527595

SCHEMBL8527595

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)C1CCC(=O)NC1=O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSS P25774 2/20 0.51
CTSL P07711 1/20 0.51
CTSB P07858 1/20 0.51
CTSK P43235 1/20 0.51
SCN9A Q15858 4/20 0.50
CCKAR P32238 1/20 0.50
CCKBR P32239 1/20 0.50
KMT2A Q03164 2/20 0.49
ACE P12821 2/20 0.49
EPHX2 P34913 1/20 0.48
AKT1 P31749 1/20 0.48
REN P00797 4/20 0.48
IDO1 P14902 1/20 0.47
MAPK1 P28482 1/20 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
SCHEMBL8527225 0.92 REN (0.55) CTSSCTSLCTSBCTSKSCN9A
SCHEMBL8531003 0.86 REN (0.49) KMT2ARENMAPK1
SCHEMBL31628521 0.84 SCN9A (0.65) CTSSCTSLCTSBCTSKSCN9A
SCHEMBL27616185 0.79 ACE (0.59) CTSSCTSLCTSBCTSKCCKAR
SCHEMBL11030896 0.79 ACE (0.59) CTSSCTSLCTSBCTSKCCKAR
SCHEMBL7705336 0.78 EPHX2 (0.53) CTSSCTSLCTSBCTSKSCN9A
SCHEMBL3870531 0.78 EPHX2 (0.53) CTSSCTSLCTSBCTSKSCN9A
SCHEMBL8527394 0.77 ALDH1A1 (0.47) REN
SCHEMBL26508667 0.77 CTSS (0.53) CTSSCTSLCTSBCTSKSCN9A
SCHEMBL7321427 0.75 ACE (0.56) CTSSCTSLCTSBCTSKSCN9A

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 3 patents. 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
US-5514778-A ENZYME INHIBITORS OF PROTEOLYTIC ENZYMES FOR RHINOVIRUSES ELI LILLY AND COMPANY (US) 1996-05-07 US disclosed
EP-0632051-A1 Anti-picornaviral agents ELI LILLY AND COMPANY (US) 1995-01-04 EP disclosed