SCHEMBL21562016

SCHEMBL21562016

Cc1oc2c(-c3cccc(CN)c3)cc(C(=O)Oc3ccccc3CC(=O)O)cc2c1C

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CFD P00746 17/20 0.50
F11 P03951 3/20 0.50
TPSB2 P20231 3/20 0.50
PLAU P00749 2/20 0.50
PLG P00747 1/20 0.50
KLKB1 P03952 1/20 0.50
F7 P08709 1/20 0.50
SELL P14151 1/20 0.46
SELP P16109 1/20 0.46
SUCNR1 Q9BXA5 1/20 0.41
PTGER1 P34995 1/20 0.40
PTGER4 P35408 1/20 0.40
PTGER3 P43115 1/20 0.40
PTGER2 P43116 1/20 0.40

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
SCHEMBL21562015 0.91 CFD (0.46) CFDF11TPSB2PLAUPLG
SCHEMBL21438005 0.85 CFD (0.64) CFDF11TPSB2PLAUPLG
SCHEMBL23656659 0.81 CFD (0.50) CFDF11TPSB2PLAUPLG
SCHEMBL23656625 0.77 CFD (0.50) CFDF11TPSB2PLAUPLG
SCHEMBL21438567 0.77 CFD (0.62) CFDF11TPSB2PLAUPLG
SCHEMBL23656559 0.76 CFD (0.51) CFDF11TPSB2PLAUPLG
SCHEMBL21437800 0.76 CFD (0.52) CFDF11TPSB2PLAUPLG
SCHEMBL29634113 0.76 CFD (0.52) CFDF11TPSB2PLAUPLG
SCHEMBL23218898 0.75 CFD (0.57) CFDF11TPSB2PLAUPLG
SCHEMBL29852513 0.75 CFD (0.57) CFDF11TPSB2PLAUPLG

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 17/4885F11 216/4885TPSB2 169/4885
US-20190345135-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS C9, C5, C1QBP CFD 17/4885F11 216/4885TPSB2 169/4885

“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.