SCHEMBL4051771

SCHEMBL4051771

CC(C[CH]C(=O)N1CCC2C1C(=O)CN2C(=O)N1CCN(C)CC1)C(N)=O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.33

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
SCHEMBL4045017 0.92 CTSK (0.33) CTSK
SCHEMBL4053300 0.91 CTSK (0.33) CTSK
SCHEMBL4043974 0.90 CTSK (0.33) CTSK
SCHEMBL4049895 0.89 CTSK (0.32) CTSK
SCHEMBL4052357 0.86 CTSK (0.32) CTSK
SCHEMBL4045288 0.81 DPP4 (0.41) CTSK
SCHEMBL4045968 0.81 CTSK (0.33) CTSK
SCHEMBL4041125 0.81 CTSK (0.35) CTSK
SCHEMBL4044092 0.80 CTSK (0.35) CTSK
SCHEMBL4042191 0.80 CTSK (0.36) CTSK

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-1546150-B1 PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES AMURA THERAPEUTICS LTD (GB) 2009-03-04 EP claimed