SCHEMBL7357995

SCHEMBL7357995

CC(C)[C@@H](C=CS(=O)(=O)c1ccccc1)NC(=O)[C@@H](N)Cc1ccc(C(=O)C2CNCCO2)cc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSB P07858 6/20 0.40
CTSC P53634 4/20 0.40
CTSK P43235 4/20 0.40
CTSS P25774 3/20 0.40
CTSH P09668 2/20 0.40
SSTR4 P31391 1/20 0.37
CTSL P07711 3/20 0.35
GHSR Q92847 1/20 0.33
CASP1 P29466 1/20 0.33

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
SCHEMBL7352274 0.89 CTSB (0.47) CTSBCTSCCTSKCTSSCTSH
SCHEMBL7354313 0.86 CTSB (0.51) CTSBCTSCCTSKCTSSCTSH
SCHEMBL7360670 0.86 CTSB (0.47) CTSBCTSCCTSKCTSSCTSH
SCHEMBL7355598 0.86 CTSB (0.56) CTSBCTSCCTSKCTSSCTSH
SCHEMBL7349455 0.86 CTSB (0.56) CTSBCTSCCTSKCTSSCTSH
SCHEMBL7360548 0.86 CTSB (0.46) CTSBCTSCCTSKCTSSCTSH
SCHEMBL7356286 0.84 CTSB (0.42) CTSBCTSCCTSKCTSSCTSH
Bromide SCHEMBL7353802 0.84 CTSB (0.44) CTSBCTSCCTSKCTSSCTSH
SCHEMBL7352947 0.82 PSMB8 (0.43) CTSBCTSCCTSKCTSSCTSH
SCHEMBL7359672 0.82 CTSC (0.38) CTSCSSTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0756625-A4 IRREVERSIBLE CYSTEINE PROTEASE INHIBITORS CONTAINING VINYL GROUPS CONJUGATED TO ELECTRON WITHDRAWING GROUPS ARRIS PHARM CORP (US) 1999-07-28 EP claimed
EP-0756625-A1 IRREVERSIBLE CYSTEINE PROTEASE INHIBITORS CONTAINING VINYL GROUPS CONJUGATED TO ELECTRON WITHDRAWING GROUPS ARRIS PHARMACEUTICAL CORPORATION (US) 1997-02-05 EP claimed
WO-1995023222-A1 IRREVERSIBLE CYSTEINE PROTEASE INHIBITORS CONTAINING VINYL GROUPS CONJUGATED TO ELECTRON WITHDRAWING GROUPS KHEPRI PHARMACEUTICALS, INC. (US) 1995-08-31 WO claimed
US-6287840-B1 PEPTIDOMIMETICS; COUPLING, DEBLOCKING; ANTIARTHRITIC, ANTITUMOR, ANTICARCINOGENIC, AND ANTIMETASTASIS AGENTS; MUSCULAR DYSTROPHY, GLOMERULONEPHRITIS, MALARIA, ALZHEIMER*S DISEASE AXYS PHARMACEUTICALS, INC. 2001-09-11 US disclosed
US-5976858-A (S)-(E)-3-(4-MORPHOLINE-CARBONYLLEUCYL)AMINO-5-PHENYL-1-PHENYL SULFONYL-1-PENTENE AND OTHERS; ANTIARTHRITIS/ANTITUMOR/ ANTIINFLAMMATORY/ANTIMETASTASIS AGENTS; TREATMENT OF MUSCULAR DYSTROPHY, MALARIA, ALZHEIMER'S AND AUTOIMMUNE DISEASES ARRIS PHARMACEUTICALS (US) 1999-11-02 US disclosed
EP-0756625-A4 IRREVERSIBLE CYSTEINE PROTEASE INHIBITORS CONTAINING VINYL GROUPS CONJUGATED TO ELECTRON WITHDRAWING GROUPS ARRIS PHARM CORP (US) 1999-07-28 EP disclosed
EP-0756625-A1 IRREVERSIBLE CYSTEINE PROTEASE INHIBITORS CONTAINING VINYL GROUPS CONJUGATED TO ELECTRON WITHDRAWING GROUPS ARRIS PHARMACEUTICAL CORPORATION (US) 1997-02-05 EP disclosed
WO-1995023222-A1 IRREVERSIBLE CYSTEINE PROTEASE INHIBITORS CONTAINING VINYL GROUPS CONJUGATED TO ELECTRON WITHDRAWING GROUPS KHEPRI PHARMACEUTICALS, INC. (US) 1995-08-31 WO disclosed