SCHEMBL17870451

SCHEMBL17870451

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nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSK P43235 10/20 0.55
CTSS P25774 6/20 0.49
PPARA Q07869 6/20 0.47
PPARG P37231 5/20 0.47
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47
ACE P12821 1/20 0.46
PPARD Q03181 2/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL14242024 1.00 CTSK (0.55) CTSKCTSSPPARAPPARGCTSL
SCHEMBL17870454 1.00 CTSK (0.55) CTSKCTSSPPARAPPARGCTSL
SCHEMBL19003825 0.94 CTSK (0.50) CTSKCTSSPPARAPPARGCTSL
SCHEMBL7426593 0.92 CTSK (0.68) CTSKCTSSPPARAPPARGCTSL
SCHEMBL1433273 0.92 CTSK (0.68) CTSKCTSSPPARAPPARGCTSL
SCHEMBL7424969 0.92 CTSK (0.68) CTSKCTSSPPARAPPARGCTSL
SCHEMBL7425896 0.92 CTSK (0.68) CTSKCTSSPPARAPPARGCTSL
SCHEMBL22412575 0.90 CTSK (0.50) CTSKCTSSPPARAPPARGCTSL
SCHEMBL22412574 0.90 CTSK (0.50) CTSKCTSSPPARAPPARGCTSL
SCHEMBL22412573 0.90 CTSK (0.50) CTSKCTSSPPARAPPARGCTSL

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 CTSK 194/4885CTSS 203/4885PPARA 2535/4885
US-20180265547-A1 Z-SELECTIVE OLEFIN METATHESIS OF PEPTIDES QPCT, PTMS, MAX CTSK 194/4885CTSS 203/4885PPARA 2535/4885

“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.