SCHEMBL7327671

SCHEMBL7327671

C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)O.O=C(CBr)CBr

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 2/20 0.58
CTSL P07711 5/20 0.57
CTSS P25774 2/20 0.57
CTSK P43235 2/20 0.57
PTPN1 P18031 1/20 0.52
LTA4H P09960 2/20 0.51
MME P08473 1/20 0.51
CTSB P07858 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ACE P12821 2/20 0.50
BACE1 P56817 1/20 0.50

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
SCHEMBL7315385 1.00 PSMB5 (0.58) PSMB5CTSLCTSSCTSKPTPN1
SCHEMBL10119250 0.92 PSMB5 (0.65) PSMB5CTSLCTSSCTSKPTPN1
SCHEMBL7318555 0.92 PSMB5 (0.65) PSMB5CTSLCTSSCTSKPTPN1
SCHEMBL7315389 0.90 PSMB5 (0.60) PSMB5CTSLCTSSCTSKLTA4H
SCHEMBL10119263 0.86 CTSS (0.60) PSMB5CTSLCTSSCTSKMME
SCHEMBL10118946 0.86 CTSS (0.67) PSMB5CTSLCTSSCTSKPTPN1
SCHEMBL14297648 0.86 CTSS (0.60) PSMB5CTSLCTSSCTSKMME
SCHEMBL9818634 0.85 CAPN1 (0.47) PSMB5LTA4HMMEACE
SCHEMBL14297659 0.84 PSMB5 (0.56) PSMB5CTSLCTSSCTSKLTA4H
SCHEMBL12516880 0.84 PSMB5 (0.56) PSMB5CTSLCTSSCTSKLTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0272671-B1 Aryloxy and arylacyloxy methyl ketones as thiol protease inhibitors SANDOZ LTD (CH) 1994-03-16 EP disclosed
US-5158936-A Treating or prevention of tissue damage, inflammation, bone resporpption and muscular dystrophy SYNTEX (U.S.A.) INC. (US) 1992-10-27 US disclosed
US-5055451-A Prevent tissue damage SYNTEX INC. (US) 1991-10-08 US disclosed
EP-0272671-A2 Aryloxy and arylacyloxy methyl ketones as thiol protease inhibitors SANDOZ LTD. (CH) 1988-06-29 EP disclosed