SCHEMBL26026883

SCHEMBL26026883

CC(C)[C@H](N)C(=O)NC(CCCCNN)C(=O)Nc1ccc(O[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SIRT1 Q96EB6 8/20 0.38
▸ SIRT2 Q8IXJ6 9/20 0.35
▸ PDF Q9HBH1 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ HTT P42858 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ KLKB1 P03952 1/20 0.33
▸ FURIN P09958 2/20 0.33
▸ SIRT3 Q9NTG7 3/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ LTA4H P09960 1/20 0.33

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
SCHEMBL26026727 0.88 SMN1; SMN2 (0.38) SIRT1SIRT2PDFCA1CA2
SCHEMBL29649566 0.88 SMN1; SMN2 (0.38) SIRT1SIRT2PDFCA1CA2
SCHEMBL29649455 0.85 SIRT1 (0.37) SIRT1SIRT2KDM4EMAPTNPSR1
SCHEMBL26026882 0.84 LTA4H (0.45) LTA4H
SCHEMBL26027084 0.80 KLKB1 (0.51) SIRT1HTTMAPTKLKB1KMT2A
SCHEMBL17805765 0.78 KLKB1 (0.40) CA1CA2HTTKDM4EMAPT
SCHEMBL26026941 0.78 FURIN (0.35) FURIN
SCHEMBL16392367 0.77 SPHK1 (0.40) KLKB1FURIN
SCHEMBL16847756 0.77 SPHK1 (0.40) KLKB1FURIN
SCHEMBL16424794 0.76 CA1 (0.47) SIRT1SIRT2CA1CA2KDM4E

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-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF ELUCIDA ONCOLOGY, INC. 2023-08-03 — — 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-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF NDC1, KIFC1, SDCBP SIRT1 2353/4885SIRT2 2798/4885PDF 633/4885

“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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