SCHEMBL8249221

SCHEMBL8249221

O=C1N[C@]2(C(=O)NS(=O)(=O)C3CC3)C[C@H]2/C=C\CCCCCCC(=O)N2CCC[C@@H]12

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CTSB P07858 1/20 0.41
▸ CTSS P25774 1/20 0.38
▸ PSMB9 P28065 9/20 0.31
▸ PSMB8 P28062 3/20 0.31

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
SCHEMBL7914476 1.00 CTSB (0.41) CTSBCTSSPSMB9PSMB8
SCHEMBL15509453 1.00 CTSB (0.41) CTSBCTSSPSMB9PSMB8
SCHEMBL15509452 1.00 CTSB (0.41) CTSBCTSSPSMB9PSMB8
SCHEMBL15509451 1.00 CTSB (0.41) CTSBCTSSPSMB9PSMB8
SCHEMBL13502758 0.89 CTSB (0.40) CTSBCTSS
SCHEMBL8246800 0.88 CTSB (0.34) CTSBCTSSPSMB9PSMB8
SCHEMBL11976284 0.88 CTSB (0.42) CTSBCTSS
SCHEMBL11976283 0.88 CTSB (0.41) CTSBCTSS
SCHEMBL13082504 0.88 CTSB (0.42) CTSBCTSS
Hydrochloric Acid SCHEMBL4522873 0.87 CTSB (0.41) CTSBCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2477980-B1 HCV PROTEASE INHIBITORS TAIGEN BIOTECHNOLOGY CO LTD (TW) 2016-06-08 — — EP disclosed
US-8765667-B2 HCV protease inhibitors EISSENSTAT MICHAEL (US) 2014-07-01 — — US disclosed
US-20110182854-A1 HCV PROTEASE INHIBITORS SEQUOIA PHARMACEUTICALS, INC. (US) 2011-07-28 — — US disclosed
WO-2010107739-A2 METHODS AND COMPOSITIONS OF TREATING A FLAVIVIRIDAE FAMILY VIRAL INFECTION THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2010-09-23 — — WO disclosed
WO-2007015824-A2 NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2007-02-08 — — 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-20110182854-A1 HCV PROTEASE INHIBITORS SERPINB1, CTSC, HPN CTSB 31/4885CTSS 33/4885PSMB9 434/4885

“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.

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