SCHEMBL889554

SCHEMBL889554

CC[C@H]1O[C@@H](n2cnc3c(NC(=O)OC(C)(C)C)ncnc32)CC1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.42
ADORA1 P30542 2/20 0.40
ADORA2A P29274 1/20 0.40
P2RY1 P47900 1/20 0.39

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
SCHEMBL14788953 1.00 ADORA3 (0.42) ADORA3ADORA1ADORA2AP2RY1
SCHEMBL12570162 0.92 P2RY1 (0.41) ADORA3ADORA1ADORA2AP2RY1
SCHEMBL12570167 0.92 P2RY1 (0.41) ADORA3ADORA1ADORA2AP2RY1
SCHEMBL889533 0.83 HIF1A (0.38) ADORA3ADORA1ADORA2AP2RY1
SCHEMBL17920409 0.82 ADORA3 (0.45) ADORA3ADORA1ADORA2AP2RY1
SCHEMBL22589997 0.82 P2RY1 (0.45) ADORA3P2RY1
SCHEMBL25397271 0.81 KDM4E (0.52) ADORA3ADORA2A
SCHEMBL26799264 0.81 KDM4E (0.52) ADORA3ADORA2A
SCHEMBL13626303 0.81 KDM4E (0.52) ADORA3ADORA2A
SCHEMBL14789004 0.81 P2RY1 (0.36) ADORA1ADORA2AP2RY1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20130095471-A1 3'-OH UNBLOCKED NUCLEOTIDES AND NUCLEOSIDES BASE MDIFIED WITH NON-CLEAVABLE, TERMINATING GROUPS AND METHODS FOR THEIR USE IN DNA SEQUENCING WU WEIDONG (US) 2013-04-18 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-8198029-B2 3'-OH unblocked nucleotides and nucleosides base modified with non-cleavable, terminating groups and methods for their use in DNA sequencing LASERGEN, INC (US) 2012-06-12 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-20110200988-A1 3'-OH unblocked uncleotides and nucleosides base modified with non-cleavable, terminating groups and methods for their use in DNA squencing AGILENT TECHNOLOGIES, INC. 2011-08-18 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-20130095471-A1 3'-OH UNBLOCKED NUCLEOTIDES AND NUCLEOSIDES BASE MDIFIED WITH NON-CLEAVABLE, TERMINATING GROUPS AND METHODS FOR THEIR USE IN DNA SEQUENCING NT5C3B, UNG, OGG1 ADORA3 184/4885ADORA1 467/4885ADORA2A 387/4885
US-20130072388-A1 PHOTOCLEAVABLE LABELED NUCLEOTIDES AND NUCLEOSIDES AND METHODS FOR THEIR USE IN IN DNA SEQUENCING UNG, NT5C3B, OGG1 ADORA3 117/4885ADORA1 290/4885ADORA2A 174/4885

“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.