SCHEMBL29121970

SCHEMBL29121970

Nc1nccc2ccc(-c3cnc4c(c3)c(COc3ccccc3CC(=O)O)nn4C3CCC3)cc12

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CFD P00746 15/20 0.37
F11 P03951 8/20 0.37
KLKB1 P03952 5/20 0.37
PLG P00747 3/20 0.37
PLAU P00749 3/20 0.37
F7 P08709 3/20 0.37
TPSB2 P20231 3/20 0.37
EGFR P00533 4/20 0.37
BTK Q06187 3/20 0.37
F2 P00734 2/20 0.35
F9 P00740 2/20 0.35
F10 P00742 2/20 0.35
PLAT P00750 2/20 0.35
PTGS1 P23219 1/20 0.34
SLC18A2 Q05940 1/20 0.34
PDE4D Q08499 1/20 0.34
KCNH2 Q12809 1/20 0.34

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
SCHEMBL29122130 0.91 CFD (0.38) CFDF11KLKB1PLGPLAU
SCHEMBL29340562 0.90 CFD (0.41) CFDEGFRBTK
SCHEMBL29122838 0.89 CFD (0.38) CFDF11KLKB1PLGPLAU
SCHEMBL29122664 0.89 CFD (0.40) CFDF11KLKB1PLGPLAU
SCHEMBL29121851 0.88 CFD (0.37) CFDF11KLKB1PLGPLAU
SCHEMBL29345883 0.87 EGFR (0.35) CFDEGFRBTK
SCHEMBL29122662 0.87 CFD (0.39) CFDF11KLKB1PLGPLAU
SCHEMBL29121999 0.86 GSK3B (0.42) CFDF11KLKB1PLGPLAU
SCHEMBL29122164 0.84 KDM4C (0.36) KLKB1EGFRBTKF10
SCHEMBL29121608 0.84 CFD (0.38) CFDF11KLKB1PLGPLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-07-18 US disclosed
US-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-07-18 US disclosed
US-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-07-18 US disclosed
CN-117120419-A KLK5 bicyclic heteroaromatic inhibitors 拜奥克里斯特制药公司 2023-11-24 CN 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 (1 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-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 KLK5, KLK1, KLKB1 CFD 3529/4885F11 1832/4885KLKB1 3/4885

“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.