SCHEMBL27291534

SCHEMBL27291534

CCc1ccc(NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)CNC(=O)CNC)C(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 6/20 0.48
▸ KLKB1 P03952 1/20 0.42
▸ PDF Q9HBH1 1/20 0.42
▸ HTT P42858 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ SSTR3 P32745 1/20 0.39
▸ CALCRL Q16602 1/20 0.38
▸ PLG P00747 1/20 0.37
▸ MMP3 P08254 2/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CTSL P07711 1/20 0.36

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
SCHEMBL27291531 0.88 FURIN (0.49) FURINKLKB1PDFHTTTP53
SCHEMBL29342074 0.85 KLKB1 (0.42) FURINKLKB1PDFSSTR3CALCRL
SCHEMBL24864487 0.85 KLKB1 (0.44) FURINKLKB1PDFSSTR3CALCRL
SCHEMBL27291530 0.81 FURIN (0.51) FURINKLKB1PDFHTTTP53
SCHEMBL24101471 0.81 PDF (0.45) FURINKLKB1PDFSSTR3CALCRL
SCHEMBL17235987 0.79 FURIN (0.40) FURINHTT
SCHEMBL22602062 0.78 SIRT2 (0.44) FURINMMP3
SCHEMBL21234897 0.77 FURIN (0.48) FURINKLKB1PDFHTTTP53
SCHEMBL27291528 0.77 FURIN (0.49) FURINHTTTP53SMN1; SMN2
SCHEMBL17424310 0.77 SPHK1 (0.51) KLKB1PDFSSTR3PLGCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240207429-A1 LINKERS, DRUG LINKERS AND CONJUGATES THEREOF AND METHODS OF USING THE SAME WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-06-27 — — 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 (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-20240207429-A1 LINKERS, DRUG LINKERS AND CONJUGATES THEREOF AND METHODS OF USING THE SAME PAICS, DHFR, CD44 FURIN 34/4885KLKB1 2818/4885PDF 297/4885

“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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