SCHEMBL21562002

SCHEMBL21562002

COCC(C)OC(=O)Cc1ccccc1OCc1cc(-c2cccc(CN)c2)c2oc(CNCc3cccnc3)cc2c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CFD P00746 11/20 0.45
PLG P00747 1/20 0.39
PLAU P00749 1/20 0.39
F11 P03951 1/20 0.39
KLKB1 P03952 1/20 0.39
F7 P08709 1/20 0.39
TPSB2 P20231 1/20 0.39
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
PDCD1 Q15116 5/20 0.38
CD274 Q9NZQ7 5/20 0.38
LMNA P02545 1/20 0.37

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
SCHEMBL23656602 0.90 CFD (0.44) CFDPLGPLAUF11KLKB1
SCHEMBL23656572 0.89 CFD (0.46) CFDPLGPLAUF11KLKB1
SCHEMBL23425599 0.88 CFD (0.43) CFDPLGPLAUF11KLKB1
SCHEMBL21437662 0.88 CFD (0.49) CFDPLGPLAUF11KLKB1
SCHEMBL21562049 0.88 CFD (0.49) CFDPLGPLAUF11KLKB1
SCHEMBL21437726 0.87 CFD (0.59) CFDPLGPLAUF11KLKB1
SCHEMBL23425593 0.87 CFD (0.48) CFDPLGPLAUF11KLKB1
SCHEMBL23656616 0.87 CFD (0.45) CFDPLGPLAUF11KLKB1
SCHEMBL21561778 0.87 CFD (0.49) CFDPLGPLAUF11KLKB1
SCHEMBL23425641 0.86 CFD (0.47) CFDPLGPLAUF11KLKB1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11021458-B2 Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2021-06-01 US disclosed
US-20190345135-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2019-11-14 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-11021458-B2 Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors C9, C5, C1QBP CFD 17/4885PLG 573/4885PLAU 2021/4885
US-20190345135-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS C9, C5, C1QBP CFD 17/4885PLG 573/4885PLAU 2021/4885

“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.