SCHEMBL21564397

SCHEMBL21564397

CC(C)(C)OC(=O)NCCNc1ccc(Oc2cc(CN3CCOCC3)cc(-c3cc(Cl)cc(Cl)c3)c2)cn1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.38
▸ FURIN P09958 9/20 0.38
▸ F10 P00742 2/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ EPAS1 Q99814 1/20 0.37
▸ DRD2 P14416 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ BDKRB1 P46663 1/20 0.36
▸ CD274 Q9NZQ7 1/20 0.36
▸ MELK Q14680 1/20 0.35
▸ F2 P00734 1/20 0.35

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
SCHEMBL21551183 0.89 FURIN (0.40) FURINF10HIF1AEPAS1KDM4E
SCHEMBL21551391 0.83 LRRK2 (0.39) FURINF10HIF1AEPAS1KDM4E
SCHEMBL29892246 0.83 LRRK2 (0.39) FURINF10HIF1AEPAS1KDM4E
SCHEMBL21564564 0.78 FURIN (0.53) FURINDRD2
SCHEMBL29890782 0.78 FURIN (0.53) FURINDRD2
SCHEMBL21551137 0.78 STK17B (0.41) BRD4DRD2KDM4E
SCHEMBL21551136 0.77 STK17B (0.40) BRD4DRD2
SCHEMBL21564565 0.77 STK17B (0.40) BRD4DRD2
SCHEMBL28555951 0.77 STK17B (0.44) BRD4DRD2
SCHEMBL28911635 0.76 STK17B (0.45) BRD4DRD2

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 8 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
EP-3790871-B1 FURIN INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2024-01-24 — — EP disclosed
US-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 — — US disclosed
US-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 — — US disclosed
US-20220315556-A1 FURIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2022-10-06 — — US disclosed
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
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220315556-A1 FURIN INHIBITORS FURIN, TGFB1, PCSK7 BRD4 3263/4885FURIN 1/4885F10 275/4885
US-11773078-B2 Furin inhibitors FURIN, TGFB1, PCSK7 BRD4 3263/4885FURIN 1/4885F10 275/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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