SCHEMBL22642972

SCHEMBL22642972

Cc1occc1-c1ccc(CC(N)NC(=O)[C@H]2N[C@@H]3CC[C@H]2C3)c(F)c1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 0.78
▸ CTSK P43235 19/20 0.78

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
SCHEMBL22642973 0.87 CTSC (1.00) CTSCCTSK
SCHEMBL16064723 0.87 CTSC (1.00) CTSCCTSK
SCHEMBL22643460 0.85 CTSC (0.78) CTSCCTSK
SCHEMBL22643144 0.85 CTSC (0.58) CTSCCTSK
SCHEMBL22643238 0.84 CTSC (0.77) CTSCCTSK
SCHEMBL22643420 0.83 CTSC (0.79) CTSCCTSK
SCHEMBL22643379 0.83 CTSC (0.79) CTSCCTSK
SCHEMBL22643256 0.82 CTSC (0.77) CTSCCTSK
SCHEMBL22643002 0.81 CTSC (0.63) CTSCCTSK
SCHEMBL22642966 0.81 CTSC (0.78) 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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