SCHEMBL5065012

SCHEMBL5065012

CC(C)N(C(C)C)P(O)OCCC#N.N#CCCOP(O)OO

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL252367 0.90 TSHR (0.30)
SCHEMBL7262903 0.90 TSHR (0.30)
SCHEMBL7858703 0.90 TSHR (0.30)
Hydrochloric Acid SCHEMBL25380883 0.89
SCHEMBL5063697 0.83
SCHEMBL5067027 0.83
Glycerin SCHEMBL7951846 0.81
SCHEMBL26653603 0.81
SCHEMBL23384350 0.81 TSHR (0.31)
SCHEMBL9235878 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8193384-B2 Synthesized using diphosphitylating reagents via solid-phase synthesis; antisense therapy; genetic disorders; anticarcinogenic agents, viricides Board of Governors for Higher Education, State of Rhode Island and Providence Plantation (US) 2012-06-05 US disclosed
US-20080207551-A1 MODIFIED OLIGONUCLEOTIDES CONTAINING DIPHOSPHODIESTER INTERNUCLEOTIDE LINKAGES BOARD OF GOVERNORS FOR HIGHER EDUCATION, STATE OF RHODE ISLAND AND PROVIDENCE (US) 2008-08-28 US disclosed
EP-1910394-A2 MODIFIED OLIGONUCLEOTIDES CONTAINING DIPHOSPHODIESTER INTERNUCLEOTIDE LINKAGES The Board of Governors for Higher Education State of Rhode Island And Providence Plantations (US) 2008-04-16 EP disclosed
WO-2007030227-A2 MODIFIED OLIGONUCLEOTIDES CONTAINING DIPHOSPHODIESTER INTERNUCLEOTIDE LINKAGES THE BOARD OF GOVERNORS FOR HIGHER EDUCATION, (US) 2007-03-15 WO disclosed