SCHEMBL3615924

SCHEMBL3615924

N#CCNC(=O)CC(NC=NS(=O)(=O)c1ccccc1)S(=O)(=O)Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSS P25774 13/20 0.40
CTSL P07711 13/20 0.40
CTSB P07858 4/20 0.38
CTSK P43235 4/20 0.37
MCL1 Q07820 1/20 0.34

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
SCHEMBL3621118 0.84 CTSS (0.32) CTSSCTSLCTSK
SCHEMBL3619860 0.81 CTSS (0.42) CTSSCTSLCTSBCTSK
SCHEMBL3615923 0.79 CTSS (0.47) CTSSCTSLCTSBCTSK
SCHEMBL3621517 0.76 CTSK (0.39) CTSSCTSLCTSBCTSK
SCHEMBL8300055 0.76 CTSS (0.48) CTSSCTSLCTSBCTSKMCL1
SCHEMBL5605243 0.72 CTSS (0.31) CTSSCTSLCTSK
SCHEMBL3625350 0.70 KMT2A (0.32) CTSSCTSLCTSK
SCHEMBL3621514 0.69 CTSS (0.60) CTSSCTSLCTSBCTSK
SCHEMBL13504861 0.69 CTSS (0.60) CTSSCTSLCTSBCTSK
SCHEMBL3618558 0.68 CTSS (0.34) CTSSCTSLCTSBCTSK

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7662849-B2 Amidino compounds as cysteine protease inhibitors VIROBAY, INC. (US) 2010-02-16 US disclosed
EP-1761485-A1 AMIDINO COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS Schering AG (DE) 2007-03-14 EP disclosed
US-20060264464-A1 Amidino compounds as cysteine protease inhibitors QUEST DIAGNOSTICS INVESTMENTS LLC 2006-11-23 US disclosed
WO-2004108661-A1 AMIDINO COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS AXYS PHARMACEUTICALS (US) 2004-12-16 WO 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-20060264464-A1 Amidino compounds as cysteine protease inhibitors CTSF, CTSB, CTSS CTSS 3/4885CTSL 9/4885CTSB 2/4885

“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.