SCHEMBL7448392

SCHEMBL7448392

CC(C)(C)C[C@H](NC(=O)CCc1ccccc1)C(=O)N[C@@H]1C(=O)N[C@H]1Oc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSL P07711 15/20 0.57
CTSK P43235 14/20 0.57
CTSS P25774 11/20 0.57
CTSB P07858 2/20 0.44
FFAR1 O14842 1/20 0.39
ITGB3 P05106 2/20 0.39
ITGA2B P08514 2/20 0.39

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
SCHEMBL7447217 0.88 CTSL (0.72) CTSLCTSKCTSSCTSBITGB3
SCHEMBL7449108 0.87 CTSL (0.54) CTSLCTSKCTSSCTSB
SCHEMBL7473433 0.85 CTSL (0.79) CTSLCTSKCTSSCTSB
SCHEMBL7462958 0.82 CTSL (0.59) CTSLCTSKCTSS
SCHEMBL7451447 0.82 CTSL (0.64) CTSLCTSKCTSSCTSBITGB3
SCHEMBL7451990 0.81 CTSL (0.61) CTSLCTSKCTSSCTSBITGB3
SCHEMBL7506810 0.80 CTSL (0.61) CTSLCTSKCTSSCTSBITGB3
SCHEMBL8158075 0.80 CTSL (0.61) CTSLCTSKCTSSCTSBITGB3
SCHEMBL7480570 0.79 CTSL (0.57) CTSLCTSKCTSSCTSBITGB3
SCHEMBL7452213 0.79 CTSL (0.57) CTSLCTSKCTSS

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-0950046-B1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS NAEJA PHARMACEUTICAL INC (CA) 2002-04-10 EP 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
WO-1998012176-A1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS SYNPHAR LABORATORIES INC. (US) 1998-03-26 WO disclosed