SCHEMBL20952056

SCHEMBL20952056

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nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SIRT6 Q8N6T7 1/20 0.51
▸ SIRT1 Q96EB6 1/20 0.51
▸ TLR2 O60603 3/20 0.51
▸ NMT1 P30419 5/20 0.50
▸ NMT2 O60551 4/20 0.50
▸ SIRT5 Q9NXA8 2/20 0.49
▸ CA1 P00915 2/20 0.43
▸ CA2 P00918 2/20 0.43
▸ GNPAT O15228 1/20 0.43
▸ FURIN P09958 3/20 0.41

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
SCHEMBL20952057 1.00 SIRT6 (0.51) SIRT6SIRT1TLR2NMT1NMT2
SCHEMBL18715483 0.92 TLR2 (0.48) SIRT6SIRT1TLR2NMT1NMT2
SCHEMBL18708300 0.92 TLR2 (0.48) SIRT6SIRT1TLR2NMT1NMT2
SCHEMBL16234712 0.89 NMT2 (0.53) SIRT6SIRT1TLR2NMT1NMT2
SCHEMBL16234693 0.89 NMT2 (0.53) SIRT6SIRT1TLR2NMT1NMT2
SCHEMBL16259340 0.89 NMT2 (0.53) SIRT6SIRT1TLR2NMT1NMT2
SCHEMBL16259323 0.89 NMT2 (0.53) SIRT6SIRT1TLR2NMT1NMT2
SCHEMBL16234715 0.89 NMT2 (0.53) SIRT6SIRT1TLR2NMT1NMT2
SCHEMBL16259360 0.89 NMT2 (0.53) SIRT6SIRT1TLR2NMT1NMT2
SCHEMBL16234694 0.89 NMT2 (0.53) SIRT6SIRT1TLR2NMT1NMT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11046729-B2 Dipeptide analogs as TGF-beta inhibitors SOUTHERN RESEARCH INSTITUTE (US) 2021-06-29 — — US disclosed
US-11046729-B2 Dipeptide analogs as TGF-beta inhibitors SOUTHERN RESEARCH INSTITUTE (US) 2021-06-29 — — US disclosed
EP-3700545-A1 DIPEPTIDE ANALOGS AS TGF-BETA INHIBITORS Southern Research Institute (US) 2020-09-02 — — EP disclosed
US-20190127420-A1 DIPEPTIDE ANALOGS AS TGF-BETA INHIBITORS UAB RESEARCH FOUNDATION 2019-05-02 — — US disclosed
US-20190127420-A1 DIPEPTIDE ANALOGS AS TGF-BETA INHIBITORS UAB RESEARCH FOUNDATION 2019-05-02 — — 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-20190127420-A1 DIPEPTIDE ANALOGS AS TGF-BETA INHIBITORS TGFB1, TGFB2, SMAD3 SIRT6 2383/4885SIRT1 1578/4885TLR2 417/4885
US-11046729-B2 Dipeptide analogs as TGF-beta inhibitors TGFB1, TGFB2, SMAD3 SIRT6 2383/4885SIRT1 1578/4885TLR2 417/4885

“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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