SCHEMBL17477214

SCHEMBL17477214

N#CC(CNC(=O)C12CCC(CC1)CN2)c1ccc(N2CCN(C3COC3)CC2)cc1F

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 20/20 0.48
▸ CTSK P43235 11/20 0.42

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
SCHEMBL17474633 0.81 CTSC (0.70) CTSCCTSK
SCHEMBL20384128 0.77 CTSC (0.55) CTSCCTSK
SCHEMBL17660620 0.66 RORC (0.40) CTSCCTSK
SCHEMBL31704121 0.65 CTSC (1.00) CTSCCTSK
SCHEMBL17483558 0.65 CTSC (0.64) CTSCCTSK
SCHEMBL17483511 0.63 CTSC (0.49) CTSCCTSK
SCHEMBL17474629 0.62 CTSC (0.90) CTSCCTSK
SCHEMBL20384123 0.62 CTSC (0.90) CTSCCTSK
SCHEMBL20384054 0.62 CTSC (0.57) CTSCCTSK
SCHEMBL17485376 0.62 RORC (0.42) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3174879-A1 SUBSTITUTED OXETANES AND THEIR USE AS INHIBITORS OF CATHEPSIN C Boehringer Ingelheim International GmbH (DE) 2017-06-07 — — EP disclosed
WO-2016016242-A1 SUBSTITUTED OXETANES AND THEIR USE AS INHIBITORS OF CATHEPSIN C BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-02-04 — — WO disclosed
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