SCHEMBL28547434

SCHEMBL28547434

CCOC(=O)[C@@H]1[C@@H]2CCN(Cc3cc(Oc4cnc(N5CCCNCC5)nc4)nc(-c4cc(Cl)cc(Cl)c4)c3)CC[C@@H]21

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 20/20 0.70

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
SCHEMBL28547436 1.00 FURIN (0.70) FURIN
SCHEMBL21564729 1.00 FURIN (0.70) FURIN
SCHEMBL26077993 1.00 FURIN (0.70) FURIN
SCHEMBL21551249 0.91 FURIN (0.77) FURIN
SCHEMBL26077995 0.89 FURIN (0.77) FURIN
SCHEMBL29890858 0.89 FURIN (0.77) FURIN
SCHEMBL21564747 0.89 FURIN (0.77) FURIN
SCHEMBL21557906 0.87 FURIN (0.82) FURIN
SCHEMBL21551348 0.86 FURIN (0.81) FURIN
SCHEMBL29928471 0.86 FURIN (0.94) 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
CN-112384509-A Furin inhibitors 葛兰素史密斯克莱知识产权发展有限公司 2021-02-19 — — CN disclosed
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