SCHEMBL19155045

SCHEMBL19155045

CC(C)(C)OC(=O)N1[C@H](C(=O)N[C@H](C#N)Cc2ccc(B(O)O)cc2F)[C@@H]2CC23CC[C@@H]13

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 0.39
▸ CTSK P43235 14/20 0.39

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
SCHEMBL19155057 0.85 CTSC (0.38) CTSCCTSK
SCHEMBL16075199 0.82 CTSC (0.45) CTSCCTSK
SCHEMBL18373188 0.82 CTSC (0.45) CTSCCTSK
SCHEMBL19155251 0.80 CTSC (0.60) CTSCCTSK
SCHEMBL16064417 0.76 CTSC (0.42) CTSCCTSK
SCHEMBL22643220 0.76 CTSC (0.42) CTSCCTSK
SCHEMBL16645163 0.76 CTSC (0.42) CTSCCTSK
SCHEMBL16356745 0.76 CTSC (0.53) CTSCCTSK
SCHEMBL17483539 0.71 CTSC (0.48) CTSCCTSK
SCHEMBL22642902 0.71 CTSC (0.46) 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
US-9713606-B2 Methods for treating pulmonary emphysema using substituted 2-Aza-bicyclo[2.2.1]heptane-3-carboxylic acid (benzyl-cyano-methyl)-amides inhibitors of cathepsin C BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-07-25 — — US disclosed
Send feedback