SCHEMBL22643319

SCHEMBL22643319

N#C[C@H](Cc1ccc(OCCN2CCNCC2)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 10/20 0.70

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
SCHEMBL16064709 1.00 CTSC (1.00) CTSCCTSK
SCHEMBL22643035 0.84 CTSC (0.81) CTSCCTSK
SCHEMBL22643396 0.83 CTSC (1.00) CTSCCTSK
SCHEMBL22643192 0.83 CTSC (1.00) CTSCCTSK
SCHEMBL29809304 0.82 CTSC (1.00) CTSCCTSK
SCHEMBL16042439 0.82 CTSC (1.00) CTSCCTSK
SCHEMBL22643078 0.82 CTSC (1.00) CTSCCTSK
SCHEMBL22643412 0.81 CTSC (1.00) CTSCCTSK
SCHEMBL16064505 0.80 CTSC (0.66) CTSCCTSK
SCHEMBL22643540 0.79 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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