SCHEMBL22643278

SCHEMBL22643278

N#CC(Cc1ccc(-c2ccc3c(c2)CNC3=O)cc1F)NC(=O)[C@H]1NC2CCC1C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 1.00
▸ CTSK P43235 16/20 1.00

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
SCHEMBL16064656 1.00 CTSC (1.00) CTSCCTSK
SCHEMBL16064710 0.94 CTSC (1.00) CTSCCTSK
SCHEMBL22642915 0.92 CTSC (1.00) CTSCCTSK
SCHEMBL16064610 0.92 CTSC (1.00) CTSCCTSK
SCHEMBL14821908 0.89 CTSC (1.00) CTSCCTSK
SCHEMBL22643380 0.87 CTSC (1.00) CTSCCTSK
SCHEMBL16064720 0.87 CTSC (1.00) CTSCCTSK
SCHEMBL29809112 0.87 CTSC (1.00) CTSCCTSK
SCHEMBL16042858 0.87 CTSC (1.00) CTSCCTSK
SCHEMBL21076233 0.87 CTSC (0.78) 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
Send feedback