SCHEMBL6491985

SCHEMBL6491985

CC(C)(C)ONC(=NS(=O)(=O)C(F)(F)F)NOC(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2 P00734 4/20 0.53
PRSS1 P07477 4/20 0.53
PRSS2 P07478 4/20 0.53
PRSS3 P35030 4/20 0.53

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
SCHEMBL7370215 0.83 F2 (0.56) F2PRSS1PRSS2PRSS3
SCHEMBL446590 0.73 F2 (0.44) F2PRSS1PRSS2PRSS3
SCHEMBL14165295 0.73 F2 (0.52) F2PRSS1PRSS2PRSS3
SCHEMBL6592968 0.70 F2 (0.32) F2PRSS1PRSS2PRSS3
SCHEMBL9965535 0.69 F2 (0.50) F2PRSS1PRSS2PRSS3
SCHEMBL16298358 0.68 F2 (0.40) F2PRSS1PRSS2PRSS3
SCHEMBL2369612 0.68 F2 (0.40) F2PRSS1PRSS2PRSS3
SCHEMBL2369616 0.68 F2 (0.40) F2PRSS1PRSS2PRSS3
SCHEMBL14493144 0.67 F2 (0.39) F2PRSS1PRSS2PRSS3
SCHEMBL2339827 0.67 F2 (0.50) F2PRSS1PRSS2PRSS3

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-20050234033-A1 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS 2005-10-20 US disclosed
EP-1261608-B1 DIKETOPIPERAZINE DERIVATIVES TO INHIBIT THROMBIN BEST EXPRESS WORLDWIDE LTD TRU (VG) 2004-04-28 EP 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-20050234033-A1 Inhibitors of histone deacetylase HDAC1, HDAC11, HDAC10 F2 4793/4885PRSS1 1241/4885PRSS2 1905/4885

“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.