SCHEMBL3884396

SCHEMBL3884396

C=CCON(C(C)C)C(C)C.PCl

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
SCHEMBL17923499 0.65
SCHEMBL3031019 0.65 MEN1 (0.35)
SCHEMBL1550791 0.65
SCHEMBL6750229 0.64
SCHEMBL6750234 0.64
SCHEMBL4964151 0.61
SCHEMBL28937505 0.60
SCHEMBL4590882 0.60
SCHEMBL7198310 0.60
SCHEMBL1456272 0.59

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
US-7501506-B2 Pentopyranosyl nucleic acid conjugates NANOGEN RECOGNOMICS GMBH (DE) 2009-03-10 US disclosed
US-7153955-B2 Pentopyranosyl nucleic acid arrays, and uses thereof NANOGEN RECOGNOMICS GMBH (DE) 2006-12-26 US disclosed
US-20060270840-A1 Pentopyranosyl nucleic acid conjugates SANOFI-AVENTIS S.A. (FR) 2006-11-30 US disclosed
US-20050004356-A1 Linker nucleoside, its preparation and use NANOGEN RECOGNOMICS GMBH (DE) 2005-01-06 US disclosed
US-20040198966-A1 Pentopyranosylnucleoside, its preparation and use NANOGEN RECOGNOMICS GMBH 2004-10-07 US disclosed
US-6699978-B1 Linker nucleoside, and production and use of the same NANOGEN RECOGNOMICS GMBH (DE) 2004-03-02 US disclosed
US-6608186-B1 Of given formula; use for the production of a therapeutic, diagnostic and/or electronic component; use in the construction of supramolecular units NANOGEN RECOGNOMICS GMBH (DE) 2003-08-19 US disclosed
US-6545134-B1 Reacting a nucleoside with aldehyde, ketone NANOGEN RECOGNOMICS, GMBH. (DE) 2003-04-08 US disclosed
US-20030039997-A1 Pentopyranosyl nucleic acid arrays, and uses thereof AVENTIS RESEARCH AND TECHNOLOGIES GMBH & CO. KG (DE) 2003-02-27 US disclosed