SCHEMBL887960

SCHEMBL887960

CC(c1ccc(C#CCNC(=O)C(F)(F)F)cc1[N+](=O)[O-])[C@]1(n2cnc3c(N)ncnc32)C[C@H](O)[C@@H](CO)O1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NNMT P40261 1/20 0.34
SLC29A1 Q99808 2/20 0.33
ADORA1 P30542 2/20 0.33
SLC28A1 O00337 1/20 0.33
TRDMT1 O14717 1/20 0.33
ADORA3 P0DMS8 1/20 0.32
ADORA2A P29274 1/20 0.32

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
SCHEMBL1140561 0.87 SLC28A1 (0.37) NNMTADORA1SLC28A1ADORA3ADORA2A
Phosphoric Acid SCHEMBL888221 0.87 SLC28A1 (0.35) NNMTSLC29A1ADORA1SLC28A1ADORA3
SCHEMBL888214 0.85 NNMT (0.36) NNMTSLC29A1ADORA1SLC28A1TRDMT1
SCHEMBL888231 0.82 SLC28A1 (0.40) SLC29A1ADORA1SLC28A1ADORA3ADORA2A
SCHEMBL888100 0.81 SLC28A1 (0.42) SLC29A1ADORA1SLC28A1ADORA3ADORA2A
Phosphoric Acid SCHEMBL888082 0.78 SLC28A1 (0.40) SLC29A1ADORA1SLC28A1ADORA3ADORA2A
SCHEMBL1140223 0.78 SLC28A1 (0.38) NNMTADORA1SLC28A1ADORA3ADORA2A
SCHEMBL887961 0.76 ENPP1 (0.43) NNMTSLC29A1TRDMT1
SCHEMBL12570176 0.74 SLC29A1 (0.49) SLC29A1ADORA1ADORA3
SCHEMBL12835761 0.74 SLC29A1 (0.49) SLC29A1ADORA1ADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2125856-B1 PHOTOCLEAVABLE LABELED NUCLEOTIDES AND NUCLEOSIDES AND LABELED NUCLEOTIDES AND NUCLEOSIDES AND METHODS FOR THEIR USE IN DNA SEQUENCING LASERGEN INC (US) 2016-09-14 EP disclosed
US-8969535-B2 Photocleavable labeled nucleotides and nucleosides and methods for their use in DNA sequencing LASERGEN, INC. (US) 2015-03-03 US disclosed
US-20130072388-A1 PHOTOCLEAVABLE LABELED NUCLEOTIDES AND NUCLEOSIDES AND METHODS FOR THEIR USE IN IN DNA SEQUENCING AGILENT TECHNOLOGIES, INC. 2013-03-21 US disclosed
US-8361727-B2 3′OH-unblocked, nucleotides and nucleosides base modified with labels and photocleavable, terminating groups and methods for their use in DNA sequencing LASERGEN, INC. (US) 2013-01-29 US disclosed
US-20110287427-A1 3'OH-UNBLOCKED, NUCLEOTIDES AND NUCLEOSIDES BASE MODIFIED WITH LABELS AND PHOTOCLEAVABLE, TERMINATING GROUPS AND METHODS FOR THEIR USE IN DNA SEQUENCING LASERGEN, INC. (US) 2011-11-24 US disclosed
US-7964352-B2 3′-OH unblocked nucleotides and nucleosides, base modified with labels and photocleavable, terminating groups and methods for their use in DNA sequencing LASERGEN, INC. (US) 2011-06-21 US disclosed
US-7897737-B2 Polymorphic identification; fluorescent dyes LASERGEN, INC. (US) 2011-03-01 US disclosed
US-20090081686-A1 PHOTOCLEAVABLE LABELED NUCLEOTIDES AND NUCLEOSIDES AND METHODS FOR THEIR USE IN DNA SEQUENCING AGILENT TECHNOLOGIES, INC. 2009-03-26 US disclosed
US-20080132692-A1 Photocleavable labeled nucleotides and nucleosides and methods for their use in DNA sequencing AGILENT TECHNOLOGIES, INC. 2008-06-05 US 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-20080132692-A1 Photocleavable labeled nucleotides and nucleosides and methods for their use in DNA sequencing UNG, DCLRE1B, NT5C3B NNMT 209/4885SLC29A1 213/4885ADORA1 332/4885
US-20130072388-A1 PHOTOCLEAVABLE LABELED NUCLEOTIDES AND NUCLEOSIDES AND METHODS FOR THEIR USE IN IN DNA SEQUENCING UNG, NT5C3B, OGG1 NNMT 182/4885SLC29A1 189/4885ADORA1 290/4885

“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.