SCHEMBL21551605

SCHEMBL21551605

COCCNC(=O)OCc1cc(Oc2ccc(N3CCC(N(C)C(=O)OC(C)(C)C)CC3)nc2)cc(-c2cc(Cl)cc(Cl)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 6/20 0.41
▸ PIK3CD O00329 1/20 0.36
▸ RET P07949 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ CHRM4 P08173 1/20 0.35
▸ MCHR1 Q99705 1/20 0.35
▸ AAK1 Q2M2I8 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.33
▸ KAT6A Q92794 1/20 0.33
▸ KAT8 Q9H7Z6 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MAPK8 P45983 1/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ SCN10A Q9Y5Y9 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
SCHEMBL29890855 0.85 FURIN (0.39) FURINPIK3CDRETMCHR1AAK1
SCHEMBL21551603 0.84 FURIN (0.39) FURINPIK3CDRETCHRM4MCHR1
SCHEMBL29890682 0.82 FURIN (0.37) FURINPIK3CDRETMCHR1AAK1
SCHEMBL28546916 0.81 MCHR1 (0.40) FURINRETMCHR1AAK1SCN9A
SCHEMBL28551717 0.81 MCHR1 (0.41) FURINPIK3CDRETMCHR1AAK1
SCHEMBL21551015 0.78 CKS1B (0.44) FURINRETMAPK8
SCHEMBL21564562 0.76 CKS1B (0.44) FURINRETMAPK8
SCHEMBL29890729 0.76 CKS1B (0.44) FURINRETMAPK8
SCHEMBL27044993 0.74 GPR119 (0.54) RET
SCHEMBL21551013 0.73 CKS1B (0.46) FURINRETMAPK8

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 FURIN 1/4885PIK3CD 3066/4885RET 1057/4885
US-11773078-B2 Furin inhibitors FURIN, TGFB1, PCSK7 FURIN 1/4885PIK3CD 3066/4885RET 1057/4885

“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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