SCHEMBL21551630

SCHEMBL21551630

COC(=O)c1cc(Oc2cnc(N3CCN(C(=O)O)CC3)nc2)nc(-c2cc(F)c(F)c(Cl)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 12/20 0.42
▸ GRM5 P41594 1/20 0.36
▸ OGA O60502 1/20 0.35
▸ P2RY12 Q9H244 1/20 0.35
▸ HDAC3 O15379 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ SMO Q99835 1/20 0.34
▸ FFAR4 Q5NUL3 1/20 0.33
▸ GPR119 Q8TDV5 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
SCHEMBL26077229 0.91 FURIN (0.41) FURINOGA
SCHEMBL30931876 0.90 GPR119 (0.46) FURINGPR119
SCHEMBL21555644 0.90 GPR119 (0.46) FURINGPR119
SCHEMBL29892184 0.90 GPR119 (0.46) FURINGPR119
SCHEMBL21551587 0.88 FURIN (0.53) FURINGPR119
SCHEMBL21551557 0.87 FURIN (0.48) FURINGRM5GPR119
SCHEMBL21553839 0.85 FURIN (0.53) FURINGPR119
SCHEMBL21551697 0.82 GPR119 (0.47) FURINOGAP2RY12HDAC3HDAC1
SCHEMBL21551107 0.79 GPR119 (0.45) FURINOGAP2RY12HDAC3HDAC1
SCHEMBL28547899 0.79 FURIN (0.61) 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 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 1/4885GRM5 4590/4885OGA 3209/4885
US-11773078-B2 Furin inhibitors FURIN, TGFB1, PCSK7 FURIN 1/4885GRM5 4590/4885OGA 3209/4885

“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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