SCHEMBL7469816

SCHEMBL7469816

Cc1cccc(O[C@@H]2NC(=O)[C@H]2NC(=O)[C@](C)(NC(=O)OCc2ccccc2)c2ccc3ccccc3c2)c1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSK P43235 18/20 0.47
CTSL P07711 14/20 0.47
CTSS P25774 13/20 0.47
CTSB P07858 6/20 0.40
TACR1 P25103 1/20 0.35

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
SCHEMBL7444979 1.00 CTSK (0.47) CTSKCTSLCTSSCTSBTACR1
SCHEMBL7475989 0.94 CTSK (0.54) CTSKCTSLCTSSCTSB
SCHEMBL7451336 0.86 CTSK (0.44) CTSKCTSLCTSSCTSB
SCHEMBL7474522 0.86 CTSK (0.44) CTSKCTSLCTSSCTSB
SCHEMBL7444730 0.86 CTSK (0.55) CTSKCTSLCTSSCTSB
SCHEMBL8410658 0.81 CTSK (0.53) CTSKCTSLCTSSCTSB
SCHEMBL7025275 0.81 CTSK (0.53) CTSKCTSLCTSSCTSB
SCHEMBL7444974 0.78 CTSL (0.72) CTSKCTSLCTSSCTSB
SCHEMBL7469813 0.78 CTSL (0.72) CTSKCTSLCTSSCTSB
SCHEMBL7473436 0.77 CTSK (0.60) CTSKCTSLCTSSCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0950046-B1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS NAEJA PHARMACEUTICAL INC (CA) 2002-04-10 EP claimed
US-5959123-A REACATING SUBSTITUTED AMINO ACID WITH 3-AMINO-4-SUBSTITUTED-AZETIDINE-2-ONE COMPOUND TO FORM 3, 4-DISUBSTITUTED-AZETIDINE-2-ONE COMPOUND; USEFUL FOR TREATING MUSCULAR DYSTROPHY, ARTHRITIS, VIRAL AND PARASITIC INFECTIONS SYNPHAR LABORATORIES, INC. (CA) 1999-09-28 US claimed
EP-0950046-B1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS NAEJA PHARMACEUTICAL INC (CA) 2002-04-10 EP disclosed
EP-0950046-A1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS SYNPHAR LABORATORIES INC. (CA) 1999-10-20 EP disclosed
US-5959123-A REACATING SUBSTITUTED AMINO ACID WITH 3-AMINO-4-SUBSTITUTED-AZETIDINE-2-ONE COMPOUND TO FORM 3, 4-DISUBSTITUTED-AZETIDINE-2-ONE COMPOUND; USEFUL FOR TREATING MUSCULAR DYSTROPHY, ARTHRITIS, VIRAL AND PARASITIC INFECTIONS SYNPHAR LABORATORIES, INC. (CA) 1999-09-28 US disclosed
WO-1998012176-A1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS SYNPHAR LABORATORIES INC. (US) 1998-03-26 WO disclosed