SCHEMBL4837606

SCHEMBL4837606

O=CSc1cc[c]c([N+](=O)[O-])c1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.30

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
SCHEMBL2028608 0.79 MEN1 (0.36) HSP90AA1
SCHEMBL10332553 0.75 CA2 (0.35)
SCHEMBL9008073 0.73 ALDH5A1 (0.44)
SCHEMBL29145566 0.72
SCHEMBL26325 0.70 TSHR (0.48) HSP90AA1
SCHEMBL2131010 0.68 S100A4 (0.34)
SCHEMBL6257261 0.68 SNCA (0.33)
SCHEMBL590426 0.68 TDP1 (0.44)
SCHEMBL441113 0.68 TSHR (0.45)
SCHEMBL3044183 0.68 ALDH1A1 (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7456281-B2 Nucleic acid melting analysis with saturation dyes IDAHO TECHNOLOGY, INC. 2008-11-25 US claimed
JP-2008510698-A 2008-04-10 JP claimed
EP-1774047-A2 NUCLEIC ACID MELTING ANALYSIS WITH SATURATION DYES University of Utah Research Foundation (US) 2007-04-18 EP claimed
US-20070020672-A1 Nucleic acid melting analysis with saturation dyes IDAHO TECHNOLOGY, INC. (US) 2007-01-25 US claimed
WO-2006121423-A2 NUCLEIC ACID MELTING ANALYSIS WITH SATURATION DYES UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2006-11-16 WO claimed
US-20050233335-A1 standard PCR solution with additional saturating double-stranded (ds) DNA binding dye; fluorescence; cyanine dyes UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2005-10-20 US claimed
EP-2826867-A1 Nucleic acid melting analysis with saturation dyes University of Utah Research Foundation (US) 2015-01-21 EP disclosed
EP-2574678-A1 Thio-substituted methine dyes University of Utah Research Foundation (US) 2013-04-03 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 (2 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-20070020672-A1 Nucleic acid melting analysis with saturation dyes DNA2, POLL, POLRMT HSP90AA1 89/4885
US-20050233335-A1 standard PCR solution with additional saturating double-stranded (ds) DNA binding dye; fluorescence; cyanine dyes DDB1, POLL, POLRMT HSP90AA1 625/4885

“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.