SCHEMBL1666375

SCHEMBL1666375

CC(C)(C)Cc1ccc(I)cc1[N+](=O)[O-]

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.37
PDK1 Q15118 1/20 0.37
SNCA P37840 2/20 0.36
TSHR P16473 4/20 0.35
ALDH1A1 P00352 4/20 0.35
CYP3A4 P08684 3/20 0.35
GPR35 Q9HC97 1/20 0.35
RECQL P46063 1/20 0.35
ALOX15 P16050 2/20 0.35
ALOX12 P18054 1/20 0.35
TDP1 Q9NUW8 3/20 0.33
P2RY6 Q15077 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL1665635 0.89 CYP1A2 (0.36) CYP1A2PDK1SNCATSHRALDH1A1
SCHEMBL1665240 0.84 PDK1 (0.40) CYP1A2PDK1SNCATSHRALDH1A1
SCHEMBL12348810 0.81 CYP1A2 (0.57) CYP1A2TSHRALDH1A1CYP3A4GPR35
SCHEMBL10213406 0.81 TSHR (0.56) CYP1A2TSHRALDH1A1CYP3A4GPR35
SCHEMBL27485132 0.79 PARP1 (0.37) CYP1A2PDK1SNCAALDH1A1CYP3A4
SCHEMBL888140 0.77 CYP1A2 (0.40) CYP1A2PDK1SNCATSHRALDH1A1
SCHEMBL888064 0.77 CYP1A2 (0.44) CYP1A2PDK1SNCATSHRALDH1A1
SCHEMBL14676339 0.77 CYP1A2 (0.40) CYP1A2PDK1SNCATSHRALDH1A1
SCHEMBL2064927 0.77 FBP1 (0.46) CYP1A2PDK1SNCATSHRCYP3A4
SCHEMBL16576676 0.76 SNCA (0.40) CYP1A2PDK1SNCATSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2307565-B1 REVERSIBLE NUCLEOSIDES AND NUCLEOTIDES TERMINATORS AND THEIR USE IN DNA SEQUENCING LASERGEN INC (US) 2017-11-29 EP disclosed
US-9200319-B2 Nucleotides and nucleosides and methods for their use in DNA sequencing LASERGEN, INC. (US) 2015-12-01 US disclosed
CN-102264917-B Nucleotides and nucleosides and methods for their use in DNA sequencing LASERGEN INC 2015-06-10 CN disclosed
US-20150140559-A1 NUCLEOTIDES AND NUCLEOSIDES AND METHODS FOR THEIR USE IN DNA SEQUENCING LASERGEN, INC. (US) 2015-05-21 US disclosed
US-8877905-B2 Nucleotides and nucleosides and methods for their use in DNA sequencing LASERGEN, INC. (US) 2014-11-04 US disclosed
US-20140051848-A1 NUCLEOTIDES AND NUCLEOSIDES AND METHODS FOR THEIR USE IN DNA SEQUENCING AGILENT TECHNOLOGIES, INC. 2014-02-20 US disclosed
CN-103588839-A Nucleotides and nucleosides and method for their use in DNA sequencing LASERGEN INC 2014-02-19 CN disclosed
US-8497360-B2 Nucleotides and nucleosides and methods for their use in DNA sequencing LASERGEN, INC. (US) 2013-07-30 US disclosed
US-20130035237-A1 Nucleotides and Nucleosides and Methods for their Use in DNA Sequencing AGILENT TECHNOLOGIES, INC. 2013-02-07 US disclosed
US-8148503-B2 Nucleotides and nucleosides and methods for their use in DNA sequencing LASERGEN, INC. (US) 2012-04-03 US disclosed
CN-102264917-A NUCLEOTIDES AND NUCLEOSIDES AND METHODS FOR THEIR USE IN DNA SEQUENCING 2011-11-30 CN disclosed
EP-2307565-A2 NUCLEOTIDES AND NUCLEOSIDES AND METHODS FOR THEIR USE IN DNA SEQUENCING Lasergen, Inc. (US) 2011-04-13 EP disclosed
US-20100041041-A1 NUCLEOTIDES AND NUCLEOSIDES AND METHODS FOR THEIR USE IN DNA SEQUENCING AGILENT TECHNOLOGIES, INC. 2010-02-18 US disclosed
WO-2009152353-A2 NUCLEOTIDES AND NUCLEOSIDES AND METHODS FOR THEIR USE IN DNA SEQUENCING LASERGEN, INC. (US) 2009-12-17 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 (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-20100041041-A1 NUCLEOTIDES AND NUCLEOSIDES AND METHODS FOR THEIR USE IN DNA SEQUENCING UNG, NT5C2, NT5E CYP1A2 1691/4885PDK1 4582/4885SNCA 2925/4885
US-20130035237-A1 Nucleotides and Nucleosides and Methods for their Use in DNA Sequencing UNG, NT5C2, NT5E CYP1A2 1691/4885PDK1 4582/4885SNCA 2925/4885

“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.