SCHEMBL13849693

SCHEMBL13849693

CS(=O)(=O)N1CCc2c(c(-c3ccc(CF)c(CNC(=O)c4ccc(F)cc4)c3)nn2CC(O)CN2CCC3(CCNC3=O)CC2)C1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CTSS P25774 20/20 0.52
CD74 P04233 4/20 0.45

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
SCHEMBL13849744 0.94 CTSS (0.51) CTSSCD74
SCHEMBL4090755 0.93 CTSS (0.52) CTSSCD74
SCHEMBL4090597 0.92 CTSS (0.59) CTSSCD74
SCHEMBL13849695 0.92 CTSS (0.47) CTSS
SCHEMBL14045862 0.88 CTSS (0.53) CTSSCD74
SCHEMBL4084011 0.87 CTSS (0.59) CTSSCD74
SCHEMBL13849811 0.87 CTSS (0.45) CTSSCD74
SCHEMBL4083955 0.86 CTSS (0.59) CTSSCD74
SCHEMBL13849804 0.84 CTSS (0.72) CTSSCD74
SCHEMBL4080134 0.83 CTSS (0.51) CTSS

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-20090118274-A1 MONOCYCLIC AMINOPROPYL TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S SUNESIS PHARMACEUTICALS, INC. 2009-05-07 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-20090118274-A1 MONOCYCLIC AMINOPROPYL TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S CTSS, CTSK, CTSZ CTSS 1/4885CD74 833/4885

“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.