SCHEMBL22643377

SCHEMBL22643377

Cc1c(-c2ccc(CC(C#N)NC(=O)C3NC4CCC3C4)c(F)c2)cnn1C

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 15/20 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
SCHEMBL16064701 1.00 CTSC (1.00) CTSCCTSK
SCHEMBL16064729 1.00 CTSC (1.00) CTSCCTSK
SCHEMBL16064554 0.89 CTSC (1.00) CTSCCTSK
SCHEMBL22643420 0.88 CTSC (0.79) CTSCCTSK
SCHEMBL22643379 0.88 CTSC (0.79) CTSCCTSK
SCHEMBL22643398 0.87 CTSC (1.00) CTSCCTSK
SCHEMBL16064726 0.87 CTSC (1.00) CTSCCTSK
SCHEMBL16064301 0.86 CTSC (1.00) CTSCCTSK
SCHEMBL16064772 0.85 CTSC (1.00) CTSCCTSK
SCHEMBL17615993 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
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