SCHEMBL21564405

SCHEMBL21564405

CC(=O)NCC1CCN(Cc2cc(Oc3ccc(N4CC[C@@H](O)C4)nc3)nc(-c3cc(Cl)cc(Cl)c3)c2)CC1

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 20/20 0.79

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
SCHEMBL21564452 1.00 FURIN (0.79) FURIN
SCHEMBL26077893 0.92 FURIN (0.78) FURIN
SCHEMBL30109080 0.92 FURIN (0.84) FURIN
SCHEMBL21553746 0.91 FURIN (0.82) FURIN
SCHEMBL29928046 0.91 FURIN (0.82) FURIN
SCHEMBL26077310 0.91 FURIN (0.84) FURIN
SCHEMBL21550689 0.90 FURIN (0.81) FURIN
SCHEMBL29927950 0.90 FURIN (0.81) FURIN
SCHEMBL26077413 0.90 FURIN (0.79) FURIN
SCHEMBL29928241 0.90 FURIN (0.88) FURIN

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3790871-B1 FURIN INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2024-01-24 — — EP disclosed
WO-2019215341-A1 FURIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-11-14 — — WO disclosed
US-9388132-B2 Isobaric tandem mass tags for quantitative proteomics and peptidomics WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2016-07-12 — — US disclosed
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