SCHEMBL21551137

SCHEMBL21551137

CNC(=O)OCc1cc(Oc2ccc(NCCCNC(=O)OC(C)(C)C)nc2)cc(-c2cc(Cl)cc(Cl)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ STK17B O94768 1/20 0.41
▸ STK17A Q9UEE5 1/20 0.41
▸ TOP2A P11388 1/20 0.34
▸ TOP2B Q02880 1/20 0.34
▸ CA12 O43570 4/20 0.34
▸ CA1 P00915 4/20 0.34
▸ CA2 P00918 4/20 0.34
▸ CA9 Q16790 4/20 0.34
▸ BRD4 O60885 4/20 0.34
▸ MAPT P10636 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ DRD2 P14416 3/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ DYRK1A Q13627 1/20 0.33
▸ CPB2 Q96IY4 1/20 0.33
▸ P2RX3 P56373 1/20 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
SCHEMBL28555951 0.85 STK17B (0.44) STK17BSTK17ACA12CA1CA2
SCHEMBL21564565 0.85 STK17B (0.40) STK17BSTK17ACA12CA1CA2
SCHEMBL21551136 0.85 STK17B (0.40) STK17BSTK17ACA12CA1CA2
SCHEMBL28911635 0.84 STK17B (0.45) STK17BSTK17ACA12CA1CA2
SCHEMBL21564397 0.78 BRD4 (0.38) BRD4KDM4EDRD2
SCHEMBL21551302 0.77 TOP2A (0.37) TOP2ATOP2BP2RX3
SCHEMBL21551015 0.76 CKS1B (0.44) —
SCHEMBL21550741 0.71 STK17A (0.34) STK17BSTK17A
SCHEMBL29891106 0.71 STK17A (0.34) STK17BSTK17A
SCHEMBL29890782 0.68 FURIN (0.53) DRD2

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 5 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
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
EP-3790871-A1 FURIN INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2021-03-17 — — EP disclosed
WO-2019215341-A1 FURIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-11-14 — — WO 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 STK17B 789/4885STK17A 522/4885TOP2A 4678/4885
US-11773078-B2 Furin inhibitors FURIN, TGFB1, PCSK7 STK17B 789/4885STK17A 522/4885TOP2A 4678/4885

“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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