SCHEMBL22642843

SCHEMBL22642843

CN1C(=O)Cc2ccc(-c3ccc(CC(C#N)NC(=O)C4C5CCC(C5)N4C(=O)OC(C)(C)C)c(F)c3)cc21

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 0.65
▸ CTSK P43235 14/20 0.65

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
SCHEMBL16064133 1.00 CTSC (0.65) CTSCCTSK
SCHEMBL16064534 1.00 CTSC (0.65) CTSCCTSK
SCHEMBL16064201 0.93 CTSC (0.66) CTSCCTSK
SCHEMBL16078739 0.93 CTSC (0.65) CTSCCTSK
SCHEMBL22642855 0.93 CTSC (0.65) CTSCCTSK
SCHEMBL22642873 0.93 CTSC (0.55) CTSCCTSK
SCHEMBL22642874 0.93 CTSC (0.55) CTSCCTSK
SCHEMBL16064081 0.92 CTSC (0.65) CTSCCTSK
SCHEMBL22642844 0.92 CTSC (0.65) CTSCCTSK
SCHEMBL16064139 0.92 CTSC (0.68) CTSCCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970283-B1 SUBSTITUTED 2-AZA-BICYCLO[2.2.1]HEPTANE-3-CARBOXYLIC ACID (BENZYL-CYANO-METHYL)-AMIDES INHIBITORS OF CATHEPSIN C BOEHRINGER INGELHEIM INT (DE) 2020-11-11 — — EP disclosed
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