SCHEMBL2170469

SCHEMBL2170469

CC(C)C(=O)SCCOCC[O]

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
SCHEMBL12023026 0.84 TSHR (0.40)
SCHEMBL17613682 0.82
SCHEMBL17613643 0.82
SCHEMBL14566357 0.77 HDAC3 (0.35)
SCHEMBL18179179 0.77 THRB (0.33)
SCHEMBL17613623 0.75
SCHEMBL12022580 0.74
SCHEMBL17599662 0.73 TDP1 (0.32)
SCHEMBL12022443 0.73
SCHEMBL12023181 0.73

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190144488-A1 TRITYL-MONO-GalNAc COMPOUNDS AND THEIR USE ROCHE INNOVATION CENTER COPENHAGEN A/S (DK) 2019-05-16 US claimed
EP-3442983-A1 TRITYL-MONO-Ga1NAc COMPOUNDS AND THEIR USE H. Hoffnabb-La Roche Ag (CH) 2019-02-20 EP claimed
US-20170327524-A1 GALNAC PHOSPHORAMIDITES, NUCLEIC ACID CONJUGATES THEREOF AND THEIR USE HOFFMANN-LA ROCHE INC. 2017-11-16 US claimed
WO-2017178656-A1 TRITYL-MONO-GalNAc COMPOUNDS AND THEIR USE ROCHE INNOVATION CENTER COPENHAGEN A/S (DK) 2017-10-19 WO claimed
EP-3204397-A1 GALNAC PHOSPHORAMIDITES, NUCLEIC ACID CONJUGATES THEREOF AND THEIR USE F. Hoffmann-La Roche AG (CH) 2017-08-16 EP claimed
WO-2016055601-A1 GALNAC PHOSPHORAMIDITES, NUCLEIC ACID CONJUGATES THEREOF AND THEIR USE F. HOFFMANN-LA ROCHE AG (CH) 2016-04-14 WO claimed
US-20230009757-A1 COMBINATION THERAPY FOR C3 INHIBITION APELLIS PHARMACEUTICALS, INC. (US) 2023-01-12 US disclosed
US-11338013-B2 Combination therapy for C3 inhibition APELLIS PHARMACEUTICALS, INC. (US) 2022-05-24 US disclosed
US-11248019-B2 Trityl-mono-GalNAc compounds and their use HOFFMANN-LA ROCHE INC. (US) 2022-02-15 US disclosed
US-20210017214-A1 GALNAC PHOSPHORAMIDITES, NUCLEIC ACID CONJUGATES THEREOF AND THEIR USE HOFFMANN LA ROCHE (US) 2021-01-21 US disclosed
US-20200282012-A1 COMBINATION THERAPY FOR C3 INHIBITION APELLIS PHARMACEUTICALS, INC. (US) 2020-09-10 US disclosed
EP-3526328-A1 COMBINATION THERAPY FOR C3 INHIBITION Apellis Pharmaceuticals, Inc. (US) 2019-08-21 EP disclosed
US-20190144488-A1 TRITYL-MONO-GalNAc COMPOUNDS AND THEIR USE ROCHE INNOVATION CENTER COPENHAGEN A/S (DK) 2019-05-16 US disclosed
EP-3067359-A1 SELF DELIVERING BIO-LABILE PHOSPHATE PROTECTED PRO-OLIGOS FOR OLIGONUCLEOTIDE BASED THERAPEUTICS AND MEDIATING RNA INTERFERENCE Petersen, Scott G. (US) 2016-09-14 EP disclosed
WO-2016055601-A1 GALNAC PHOSPHORAMIDITES, NUCLEIC ACID CONJUGATES THEREOF AND THEIR USE F. HOFFMANN-LA ROCHE AG (CH) 2016-04-14 WO disclosed
EP-2346883-B1 SELF DELIVERING BIO-LABILE PHOSPHATE PROTECTED PRO-OLIGOS FOR OLIGONUCLEOTIDE BASED THERAPEUTICS AND MEDIATING RNA INTERFERENCE PETERSEN SCOTT G (US) 2016-03-23 EP disclosed
US-20140329775-A1 SELF DELIVERING BIO-LABILE PHOSPHATE PROTECTED PRO-OLIGOS FOR OLIGONUCLEOTIDE BASED THERAPEUTICS AND MEDIATING RNA INTERFERENCE PETERSEN SCOTT G (US) 2014-11-06 US disclosed
US-20110294869-A1 SELF DELIVERING BIO-LABILE PHOSPHATE PROTECTED PRO-OLIGOS FOR OLIGONUCLEOTIDE BASED THERAPEUTICS AND MEDIATING RNA INTERFERENCE TRAVERSA THERAPEUTICS, INC. (US) 2011-12-01 US disclosed
EP-2346883-A2 SELF DELIVERING BIO-LABILE PHOSPHATE PROTECTED PRO-OLIGOS FOR OLIGONUCLEOTIDE BASED THERAPEUTICS AND MEDIATING RNA INTERFERENCE Traversa Therapeutics, Inc. (US) 2011-07-27 EP disclosed
WO-2010039543-A2 SELF DELIVERING BIO-LABILE PHOSPHATE PROTECTED PRO-OLIGOS FOR OLIGONUCLEOTIDE BASED THERAPEUTICS AND MEDIATING RNA INTERFERENCE TRAVERSA THERAPEUTICS, INC. (US) 2010-04-08 WO disclosed