SCHEMBL22643159

SCHEMBL22643159

COCCN1C(=O)Cc2ccc(-c3ccc(C[C@@H](C#N)NC(=O)C4NC5CCC4C5)c(F)c3)cc21

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 12/20 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
SCHEMBL16064271 1.00 CTSC (1.00) CTSCCTSK
SCHEMBL16064401 0.90 CTSC (1.00) CTSCCTSK
SCHEMBL14822152 0.90 CTSC (1.00) CTSCCTSK
SCHEMBL16064692 0.89 CTSC (1.00) CTSCCTSK
SCHEMBL29809181 0.89 CTSC (1.00) CTSCCTSK
SCHEMBL16043349 0.89 CTSC (1.00) CTSCCTSK
SCHEMBL16078858 0.89 CTSC (1.00) CTSCCTSK
SCHEMBL14822399 0.86 CTSC (1.00) CTSCCTSK
SCHEMBL16070993 0.86 CTSC (1.00) CTSCCTSK
SCHEMBL22643356 0.85 CTSC (1.00) 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