SCHEMBL23286077

SCHEMBL23286077

COc1ccc(C(NCCCC[C@H](NC(=O)[C@@H](NC(=O)OCC[Si](C)(C)C)C(C)C)C(=O)Nc2ccc(CO)cc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 8/20 0.39
▸ SIRT1 Q96EB6 8/20 0.39
▸ SIRT3 Q9NTG7 3/20 0.39
▸ SIRT5 Q9NXA8 4/20 0.39
▸ FURIN P09958 2/20 0.37
▸ CTSL P07711 1/20 0.37
▸ CTSS P25774 1/20 0.37
▸ CTSK P43235 1/20 0.37
▸ HDAC8 Q9BY41 2/20 0.37
▸ HDAC3 O15379 1/20 0.37
▸ HDAC4 P56524 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC7 Q8WUI4 1/20 0.37
▸ HDAC2 Q92769 1/20 0.37
▸ HDAC10 Q969S8 1/20 0.37
▸ HDAC11 Q96DB2 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ HDAC9 Q9UKV0 1/20 0.37
▸ HDAC5 Q9UQL6 1/20 0.37
▸ CTSD P07339 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
SCHEMBL23286092 0.95 SIRT2 (0.43) SIRT2SIRT1SIRT3SIRT5FURIN
SCHEMBL23286079 0.90 HDAC8 (0.47) SIRT2SIRT1SIRT3SIRT5HDAC8
SCHEMBL25266259 0.83 HDAC8 (0.43) SIRT2SIRT1HDAC8HDAC3HDAC4
SCHEMBL25208230 0.83 HDAC8 (0.43) SIRT2SIRT1HDAC8HDAC3HDAC4
SCHEMBL16847584 0.81 HDAC8 (0.57) SIRT2SIRT1SIRT3SIRT5HDAC8
SCHEMBL26421816 0.81 HDAC8 (0.47) SIRT2SIRT1SIRT3SIRT5HDAC8
SCHEMBL23680461 0.80 MMP3 (0.42) SIRT2SIRT1SIRT3SIRT5FURIN
SCHEMBL12476215 0.79 HDAC8 (0.44) SIRT1HDAC8HDAC3HDAC4HDAC1
SCHEMBL12476216 0.79 HDAC8 (0.44) SIRT1HDAC8HDAC3HDAC4HDAC1
SCHEMBL12683176 0.79 HDAC8 (0.44) SIRT1HDAC8HDAC3HDAC4HDAC1

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 3 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
WO-2021077317-A1 OLIGOPEPTIDE LINKER INTERMEDIATE AND PREPARATION METHOD THEREFOR 烟台迈百瑞国际生物医药股份有限公司 2021-04-29 — — WO 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 SIRT2 3512/4885SIRT1 2709/4885SIRT3 3528/4885
US-20210230218-A1 OLIGOPEPTIDE LINKER INTERMEDIATE AND PREPARATION METHOD THEREOF VIP, DNPEP, PREP SIRT2 3512/4885SIRT1 2709/4885SIRT3 3528/4885

“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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