SCHEMBL7362782

SCHEMBL7362782

CC(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)N[C@H](/C=C/S(=O)(=O)c1ccccc1)CCS(C)(=O)=O

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSL P07711 7/20 0.61
CTSB P07858 6/20 0.56
CTSK P43235 5/20 0.56
CTSS P25774 4/20 0.56
CTSH P09668 2/20 0.56
CTSC P53634 2/20 0.56
PSMB5 P28074 4/20 0.46
PSMB2 P49721 4/20 0.46
PSMB1 P20618 1/20 0.44
PSMB8 P28062 1/20 0.44
PSMB10 P40306 1/20 0.44

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
SCHEMBL7362789 1.00 CTSL (0.61) CTSLCTSBCTSKCTSSCTSH
SCHEMBL7362787 1.00 CTSL (0.61) CTSLCTSBCTSKCTSSCTSH
SCHEMBL7356627 0.88 CTSL (0.61) CTSLCTSBCTSKCTSSCTSH
SCHEMBL7356643 0.88 CTSL (0.61) CTSLCTSBCTSKCTSSCTSH
SCHEMBL7356648 0.88 CTSL (0.61) CTSLCTSBCTSKCTSSCTSH
SCHEMBL7361758 0.87 CTSL (0.60) CTSLCTSBCTSKCTSSCTSH
SCHEMBL7399319 0.87 CTSL (0.60) CTSLCTSBCTSKCTSSCTSH
SCHEMBL7354429 0.82 CTSL (0.59) CTSLCTSBCTSKCTSSCTSH
SCHEMBL7354432 0.82 CTSL (0.59) CTSLCTSBCTSKCTSSCTSH
SCHEMBL7354419 0.82 CTSL (0.59) CTSLCTSBCTSKCTSSCTSH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 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