SCHEMBL14363444

SCHEMBL14363444

CC(=O)NC(CCCCN)C(=O)CCl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT6 Q8N6T7 1/20 0.56
▸ SIRT1 Q96EB6 1/20 0.56
▸ TLR2 O60603 2/20 0.45
▸ CA1 P00915 2/20 0.44
▸ CA2 P00918 2/20 0.44
▸ CHRM2 P08172 1/20 0.44
▸ CHRM4 P08173 1/20 0.44
▸ CHRM1 P11229 1/20 0.44
▸ PAOX Q6QHF9 2/20 0.43
▸ FOLH1 Q04609 1/20 0.41
▸ ITGB3 P05106 4/20 0.41
▸ ITGA2B P08514 4/20 0.41
▸ CPA1 P15085 1/20 0.37
▸ CPA2 P48052 1/20 0.37
▸ CPA4 Q9UI42 1/20 0.37
▸ GNPAT O15228 1/20 0.37
▸ NMT2 O60551 1/20 0.36
▸ NMT1 P30419 1/20 0.36
▸ GNAI3 P08754 1/20 0.36
▸ GNAO1 P09471 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
SCHEMBL13998248 0.84 SIRT6 (0.57) SIRT6SIRT1TLR2CA1CA2
SCHEMBL21566740 0.84 SIRT6 (0.57) SIRT6SIRT1TLR2CA1CA2
SCHEMBL10050111 0.83 SIRT6 (0.52) SIRT6SIRT1TLR2CA1CA2
SCHEMBL19630974 0.83 SIRT6 (0.52) SIRT6SIRT1TLR2CA1CA2
SCHEMBL20435077 0.82 SIRT6 (0.58) SIRT6SIRT1TLR2CA1CA2
SCHEMBL12749404 0.82 SIRT6 (0.58) SIRT6SIRT1TLR2CA1CA2
SCHEMBL20435058 0.82 SIRT6 (0.58) SIRT6SIRT1TLR2CA1CA2
SCHEMBL20196381 0.81 SIRT6 (0.58) SIRT6SIRT1TLR2CA1CA2
SCHEMBL11896083 0.80 SIRT6 (0.56) SIRT6SIRT1TLR2CA1CA2
SCHEMBL726302 0.80 SIRT6 (0.56) SIRT6SIRT1TLR2CA1CA2

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-20070269832-A1 Novel affinity labels IMMUNOCHEMISTRY TECHNOLOGIES, LLC 2007-11-22 — — US disclosed
US-20070269832-A1 Novel affinity labels IMMUNOCHEMISTRY TECHNOLOGIES, LLC 2007-11-22 — — 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-20070269832-A1 Novel affinity labels ANPEP, SLC7A1, DNPEP SIRT6 4603/4885SIRT1 4689/4885TLR2 4639/4885

“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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