SCHEMBL22643456

SCHEMBL22643456

N#C[C@H](Cc1ccc(N2CCCN3CCCC3C2)cc1F)NC(=O)C1NC2CCC1C2

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 0.94

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
SCHEMBL16064361 1.00 CTSC (1.00) CTSCCTSK
SCHEMBL22643336 0.97 CTSC (1.00) CTSCCTSK
SCHEMBL16064314 0.97 CTSC (1.00) CTSCCTSK
SCHEMBL26510721 0.90 CTSC (0.94) CTSCCTSK
SCHEMBL22643172 0.89 CTSC (1.00) CTSCCTSK
SCHEMBL16064297 0.89 CTSC (1.00) CTSCCTSK
SCHEMBL22642957 0.88 CTSC (1.00) CTSCCTSK
SCHEMBL16064707 0.88 CTSC (1.00) CTSCCTSK
SCHEMBL16042908 0.87 CTSC (1.00) CTSCCTSK
SCHEMBL22643353 0.87 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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