SCHEMBL17870508

SCHEMBL17870508

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nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
AAK1 Q2M2I8 2/20 0.34
MMP13 P45452 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL26764860 1.00 L3MBTL1 (0.39) L3MBTL1AAK1MMP13NPSR1CA1
SCHEMBL31716095 0.82 L3MBTL1 (0.38) L3MBTL1AAK1NPSR1CA1CA2
SCHEMBL31407757 0.82 AAK1 (0.36) AAK1MMP13
SCHEMBL2968992 0.82 AAK1 (0.36) L3MBTL1AAK1MMP13NPSR1
SCHEMBL2968987 0.82 AAK1 (0.36) L3MBTL1AAK1MMP13NPSR1
SCHEMBL25437612 0.82 SMN1; SMN2 (0.39) L3MBTL1AAK1MMP13SMN1; SMN2
SCHEMBL2966824 0.79 MMP13 (0.35) L3MBTL1AAK1MMP13
SCHEMBL31407669 0.79 AAK1 (0.35) AAK1MMP13
SCHEMBL2966815 0.79 MMP13 (0.35) L3MBTL1AAK1MMP13
SCHEMBL29400845 0.79 MMP13 (0.38) AAK1MMP13

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-20180265547-A1 Z-SELECTIVE OLEFIN METATHESIS OF PEPTIDES CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2018-09-20 US disclosed
US-20160185821-A1 Z-SELECTIVE OLEFIN METATHESIS OF PEPTIDES CALIFORNIA INSTITUTE OF TECHNOLOGY 2016-06-30 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-20160185821-A1 Z-SELECTIVE OLEFIN METATHESIS OF PEPTIDES QPCT, PTMS, MAX L3MBTL1 884/4885AAK1 2003/4885MMP13 842/4885
US-20180265547-A1 Z-SELECTIVE OLEFIN METATHESIS OF PEPTIDES QPCT, PTMS, MAX L3MBTL1 884/4885AAK1 2003/4885MMP13 842/4885

“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.