SCHEMBL14563111

SCHEMBL14563111

N#CC1(NC(=O)O)CC1.N#Cc1cccc2c3c([nH]c12)CCN(C(=O)C1CCCCC1)C3

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 18/20 0.78
▸ CTSB P07858 1/20 0.52

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
SCHEMBL14563157 0.92 CTSK (0.79) CTSKCTSB
SCHEMBL14563166 0.92 CTSK (0.67) CTSKCTSB
SCHEMBL14563097 0.92 CTSK (0.79) CTSKCTSB
SCHEMBL14562945 0.91 CTSK (0.66) CTSKCTSB
SCHEMBL14563071 0.91 CTSK (0.78) CTSKCTSB
SCHEMBL14563021 0.89 CTSK (0.80) CTSKCTSB
SCHEMBL14563096 0.89 CTSK (0.65) CTSKCTSB
SCHEMBL14563020 0.89 CTSK (0.79) CTSKCTSB
SCHEMBL14642111 0.89 CTSK (0.68) CTSKCTSB
SCHEMBL14563050 0.88 CTSK (0.79) CTSKCTSB

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-2170879-B1 1-CYANOCYCLOPROPYL-DERIVATIVES AS CATHEPSIN K INHIBITORS ASTRAZENECA AB (SE) 2013-01-16 — — EP claimed
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