SCHEMBL22643070

SCHEMBL22643070

N#C[C@H](Cc1ccc(-n2cc(C(F)(F)F)cn2)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 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
SCHEMBL16064793 1.00 CTSC (1.00) CTSCCTSK
SCHEMBL22643071 0.87 CTSC (1.00) CTSCCTSK
SCHEMBL16064794 0.87 CTSC (1.00) CTSCCTSK
SCHEMBL22643058 0.85 CTSC (1.00) CTSCCTSK
SCHEMBL16064647 0.85 CTSC (1.00) CTSCCTSK
SCHEMBL16064795 0.84 CTSC (1.00) CTSCCTSK
SCHEMBL21966248 0.84 CTSC (0.79) CTSCCTSK
SCHEMBL16064348 0.84 CTSC (0.84) CTSCCTSK
SCHEMBL22643442 0.83 CTSC (1.00) CTSCCTSK
SCHEMBL16064171 0.83 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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