SCHEMBL22686102

SCHEMBL22686102

C=CCCC(=O)NC(Cc1ccccc1)C(=O)NCC(=O)OCC#N

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSS P25774 11/20 0.51
CTSL P07711 9/20 0.51
CTSB P07858 8/20 0.51
CTSK P43235 7/20 0.48

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
SCHEMBL22686106 0.87 CTSS (0.48) CTSSCTSLCTSBCTSK
SCHEMBL7074223 0.86 ACE (0.47) CTSSCTSLCTSBCTSK
SCHEMBL7074221 0.86 ACE (0.47) CTSSCTSLCTSBCTSK
SCHEMBL22686103 0.85 CTSS (0.48) CTSSCTSLCTSBCTSK
SCHEMBL17949302 0.85 CTSS (0.48) CTSSCTSLCTSBCTSK
SCHEMBL22686097 0.84 CTSS (0.45) CTSSCTSLCTSBCTSK
SCHEMBL22348905 0.84 CTSS (0.45) CTSSCTSLCTSBCTSK
SCHEMBL21895863 0.78 CTSS (0.43) CTSSCTSLCTSBCTSK
SCHEMBL21895861 0.78 CTSS (0.43) CTSSCTSLCTSBCTSK
SCHEMBL22686112 0.76 ALDH1A1 (0.57)

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-20200370057-A1 Ribosome-Mediated Incorporation of Peptides and Peptidomimetics ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2020-11-26 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-20200370057-A1 Ribosome-Mediated Incorporation of Peptides and Peptidomimetics NPEPPS, DNPEP, AARS1 CTSS 2862/4885CTSL 1300/4885CTSB 2609/4885

“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.