SCHEMBL13401558

SCHEMBL13401558

COC(=O)NCCCCC(NC(=O)OC)C(=O)NC(CN1CCC(=O)C=CC1=O)CN1CCC(=O)C=CC1=O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SIRT1 Q96EB6 7/20 0.33
▸ CA1 P00915 3/20 0.32
▸ CA2 P00918 3/20 0.32
▸ SIRT2 Q8IXJ6 7/20 0.31
▸ SIRT3 Q9NTG7 3/20 0.30
▸ SIRT5 Q9NXA8 1/20 0.30
▸ EPHX1 P07099 1/20 0.30

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
SCHEMBL12721099 0.86 SIRT5 (0.39) SIRT1CA1CA2SIRT5
SCHEMBL10026185 0.77 AKT1 (0.39) SIRT1CA1CA2SIRT2SIRT3
SCHEMBL14016183 0.74 AKT1 (0.40) SIRT1CA1CA2SIRT2SIRT3
SCHEMBL10167189 0.74 AKT1 (0.37) SIRT1SIRT2EPHX1
SCHEMBL327667 0.73 SIRT1 (0.36) SIRT1CA1CA2SIRT2SIRT3
SCHEMBL13401550 0.72 — —
SCHEMBL14542727 0.72 AKT1 (0.36) SIRT1SIRT2SIRT5
SCHEMBL10066896 0.71 CPB1 (0.32) SIRT1CA1CA2SIRT2SIRT5
SCHEMBL11964062 0.69 AKT1 (0.42) SIRT1CA1CA2SIRT2SIRT3
SCHEMBL14445101 0.69 TGM2 (0.41) —

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-20100092483-A1 Compositions monovalent for CD40L binding and methods of use DOMANTIS LIMITED 2010-04-15 — — 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-20100092483-A1 Compositions monovalent for CD40L binding and methods of use CD40LG, CD40, FCGR1A SIRT1 2017/4885CA1 4301/4885CA2 4303/4885

“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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