SCHEMBL23680461

SCHEMBL23680461

CC(C)[C@H](NC(=O)OCC[Si](C)(C)C)C(=O)N[C@@H](CCCCN)C(=O)Nc1ccc(CO)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MMP3 P08254 1/20 0.42
▸ KLKB1 P03952 1/20 0.41
▸ FURIN P09958 2/20 0.40
▸ PDF Q9HBH1 1/20 0.39
▸ SSTR3 P32745 1/20 0.39
▸ SIRT2 Q8IXJ6 5/20 0.39
▸ SIRT1 Q96EB6 4/20 0.39
▸ SIRT3 Q9NTG7 3/20 0.39
▸ HTT P42858 1/20 0.38
▸ HDAC4 P56524 1/20 0.38
▸ MEF2D Q14814 1/20 0.38
▸ SIRT5 Q9NXA8 1/20 0.38
▸ PLG P00747 1/20 0.37

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
SCHEMBL23286090 0.90 HTT (0.41) FURINSIRT2SIRT1SIRT3HTT
SCHEMBL23680463 0.88 FURIN (0.39) FURINSIRT2SIRT1SIRT3HTT
SCHEMBL23286081 0.85 SSTR3 (0.53) MMP3SSTR3SIRT2SIRT1SIRT3
SCHEMBL23286092 0.84 SIRT2 (0.43) FURINSIRT2SIRT1SIRT3SIRT5
SCHEMBL23286091 0.84 HTT (0.41) HTTPLG
SCHEMBL23680458 0.81 CASP3 (0.42) SIRT2SIRT1SIRT3SIRT5
SCHEMBL24864487 0.81 KLKB1 (0.44) MMP3KLKB1FURINPDFSSTR3
SCHEMBL20332469 0.81 CA2 (0.45) FURINHDAC4SIRT5
SCHEMBL15686242 0.79 NMT2 (0.45) KLKB1FURINPDFSSTR3HDAC4
SCHEMBL29342074 0.79 KLKB1 (0.42) MMP3KLKB1FURINPDFSSTR3

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-20230128167-A1 OLIGOPEPTIDE LINKER INTERMEDIATE AND PREPARATION METHOD THEREOF MABPLEX INTERNATIONAL, LTD. (CN) 2023-04-27 — — US disclosed
US-20210230218-A1 OLIGOPEPTIDE LINKER INTERMEDIATE AND PREPARATION METHOD THEREOF MABPLEX INTERNATIONAL, LTD. (CN) 2021-07-29 — — 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-20230128167-A1 OLIGOPEPTIDE LINKER INTERMEDIATE AND PREPARATION METHOD THEREOF VIP, DNPEP, PREP MMP3 2477/4885KLKB1 220/4885FURIN 15/4885
US-20210230218-A1 OLIGOPEPTIDE LINKER INTERMEDIATE AND PREPARATION METHOD THEREOF VIP, DNPEP, PREP MMP3 2477/4885KLKB1 220/4885FURIN 15/4885

“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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