SCHEMBL7513191

SCHEMBL7513191

O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCOC1=O)OCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSL P07711 11/20 0.67
CTSK P43235 9/20 0.60
CTSB P07858 8/20 0.60
CTSS P25774 4/20 0.60

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
SCHEMBL7512878 0.94 CTSL (0.65) CTSLCTSKCTSBCTSS
SCHEMBL4535888 0.89 CTSK (0.76) CTSLCTSKCTSBCTSS
SCHEMBL7513070 0.85 SCN9A (0.61) CTSLCTSKCTSBCTSS
SCHEMBL7511180 0.84 MEN1 (0.63)
SCHEMBL3169636 0.84 MEN1 (0.63)
SCHEMBL6060180 0.84 MEN1 (0.63)
SCHEMBL7514927 0.83 CTSK (0.77) CTSLCTSKCTSBCTSS
SCHEMBL7288696 0.81 MEN1 (0.52) CTSLCTSKCTSBCTSS
SCHEMBL7451896 0.81 CTSL (1.00) CTSLCTSKCTSBCTSS
SCHEMBL7448502 0.81 CTSL (1.00) CTSLCTSKCTSBCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0641800-B1 Lactol derivatives as inhibitors of cathepsin L TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2002-01-16 EP disclosed
US-5496834-A PEPTIDE DERIVATIVES AS CATHEPSIN L INHIBITORS AND INHIBITORS OF BONE RESORPTION OR TREATMENT OF OSTEOPOROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-03-05 US disclosed
EP-0641800-A1 Lactol derivatives as inhibiters of cathepsin L Takeda Chemical Industries, Ltd. (JP) 1995-03-08 EP disclosed