SCHEMBL24393479

SCHEMBL24393479

CCNCc1ccc(NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(C)C)C(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDF Q9HBH1 1/20 0.44
▸ FURIN P09958 4/20 0.42
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ KLKB1 P03952 1/20 0.40
▸ SSTR3 P32745 1/20 0.40
▸ PLG P00747 1/20 0.38
▸ CALCRL Q16602 1/20 0.38
▸ TLR2 O60603 1/20 0.37
▸ MMP3 P08254 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ LTA4H P09960 1/20 0.35

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
SCHEMBL24101471 0.81 PDF (0.45) PDFFURINCA1CA2KLKB1
SCHEMBL27291531 0.80 FURIN (0.49) PDFFURINCA1CA2KLKB1
SCHEMBL24393476 0.77 FURIN (0.40) FURINMMP3
SCHEMBL20149172 0.77 FURIN (0.49) FURINGAA
SCHEMBL24864663 0.74 KLKB1 (0.48) PDFCA1CA2KLKB1SSTR3
SCHEMBL27291534 0.74 FURIN (0.48) PDFFURINCA1CA2KLKB1
SCHEMBL15686242 0.73 NMT2 (0.45) PDFFURINKLKB1SSTR3PLG
SCHEMBL24864484 0.73 KLKB1 (0.47) PDFCA1CA2KLKB1SSTR3
SCHEMBL24864487 0.73 KLKB1 (0.44) PDFFURINCA1CA2KLKB1
SCHEMBL24390289 0.73 SIRT1 (0.45) PDFFURINKLKB1SSTR3MMP3

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-20220133902-A1 Composition Comprising a Combination of Immune Checkpoint Inhibitor and Antibody-Amatoxin Conjugate for Use in Cancer Therapy HEIDELBERG PHARMA RESEARCH GMBH (DE) 2022-05-05 — — 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-20220133902-A1 Composition Comprising a Combination of Immune Checkpoint Inhibitor and Antibody-Amatoxin Conjugate for Use in Cancer Therapy CD47, CD274, PDCD1LG2 PDF 1695/4885FURIN 956/4885CA1 2301/4885

“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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