SCHEMBL27048874

SCHEMBL27048874

COC(=O)NCC1CCN(Cc2cc(Oc3ccc(N4CCN(C)CC4)nc3)nc(-c3cc(I)cc(I)c3)c2)CC1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 19/20 0.66
▸ CHRM4 P08173 1/20 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
SCHEMBL21564545 0.92 FURIN (0.78) FURIN
SCHEMBL21550808 0.85 FURIN (0.88) FURIN
SCHEMBL29928241 0.85 FURIN (0.88) FURIN
SCHEMBL26077348 0.85 FURIN (0.74) FURIN
SCHEMBL21551402 0.85 FURIN (0.79) FURIN
SCHEMBL21564430 0.84 FURIN (0.73) FURIN
SCHEMBL29928348 0.84 FURIN (0.86) FURIN
SCHEMBL21550669 0.84 FURIN (0.86) FURIN
SCHEMBL23364557 0.83 FURIN (0.82) FURIN
SCHEMBL29890827 0.83 FURIN (0.82) 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 1 patent. 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
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