SCHEMBL17870146

SCHEMBL17870146

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nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.53
CTSS P25774 2/20 0.53
CA2 P00918 3/20 0.44
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ATM Q13315 1/20 0.36
CA1 P00915 1/20 0.36
CA7 P43166 1/20 0.36
BRD4 O60885 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
SCHEMBL17870147 1.00 CTSK (0.53) CTSKCTSSCA2CTSLCTSB
SCHEMBL17884331 0.87 CTSK (0.63) CTSKCTSSCA2CTSLCTSB
SCHEMBL17880448 0.83 CTSK (0.59) CTSKCTSSCA2CTSLCTSB
SCHEMBL17880414 0.83 CTSK (0.59) CTSKCTSSCA2CTSLCTSB
SCHEMBL17884299 0.82 CTSK (0.58) CTSKCTSSCA2CTSLCTSB
SCHEMBL17884343 0.82 CTSK (0.58) CTSKCTSSCA2CTSLCTSB
SCHEMBL17880434 0.82 CTSK (0.58) CTSKCTSSCA2CTSLCTSB
SCHEMBL17884341 0.80 CTSK (0.53) CTSKCTSSCA2CTSLCTSB
SCHEMBL5873406 0.78 CTSK (0.65) CTSKCTSSCA2CTSLCTSB
SCHEMBL7754405 0.78 CTSK (0.65) CTSKCTSSCA2CTSLCTSB

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 203/4885CA2 3535/4885
US-20180265547-A1 Z-SELECTIVE OLEFIN METATHESIS OF PEPTIDES QPCT, PTMS, MAX CTSK 194/4885CTSS 203/4885CA2 3535/4885

“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.