SCHEMBL20511463

SCHEMBL20511463

O=C(CBr)OCC(Br)Br

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
SCHEMBL11036622 0.84 ALDH1A1 (0.50)
SCHEMBL9407811 0.80 ALDH1A1 (0.46)
SCHEMBL28465568 0.78 ALDH1A1 (0.48)
SCHEMBL10416240 0.77
SCHEMBL537525 0.77
SCHEMBL7976838 0.77
SCHEMBL7753418 0.75 ALDH1A1 (0.46)
SCHEMBL8442017 0.74 TRPA1 (0.63)
SCHEMBL11601261 0.72
SCHEMBL9925374 0.72 ALDH1A1 (0.54)

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-20210206809-A1 PEPTIDE NUCLEIC ACID (PNA) MONOMERS WITH AN ORTHOGONALLY PROTECTED ESTER MOIETY VERA THERAPEUTICS INC (US) 2021-07-08 US disclosed
US-20210171437-A1 PEPTIDE NUCLEIC ACID (PNA) MONOMERS WITH AN ORTHOGONALLY PROTECTED ESTER MOIETY AND NOVEL INTERMEDIATES AND METHODS RELATED THERETO VERA THERAPEUTICS INC (US) 2021-06-10 US disclosed
EP-3655388-A1 PEPTIDE NUCLEIC ACID (PNA) MONOMERS WITH AN ORTHOGONALLY PROTECTED ESTER MOIETY AND NOVEL INTERMEDIATES AND METHODS RELATED THERETO Trucode Gene Repair, Inc. (US) 2020-05-27 EP disclosed
EP-3601237-A2 PEPTIDE NUCLEIC ACID (PNA) MONOMERS WITH AN ORTHOGONALLY PROTECTED ESTER MOIETY Trucode Gene Repair, Inc. (US) 2020-02-05 EP disclosed
CN-110740994-A Peptide Nucleic Acid (PNA) monomers with orthogonally protected ester moieties 特鲁科德基因修复公司 2020-01-31 CN disclosed
US-20190055190-A1 PEPTIDE NUCLEIC ACID (PNA) MONOMERS WITH AN ORTHOGONALLY PROTECTED ESTER MOIETY AND NOVEL INTERMEDIATES AND METHODS RELATED THERETO NEUBASE THERAPEUTICS, INC. 2019-02-21 US disclosed
WO-2019018422-A1 PEPTIDE NUCLEIC ACID (PNA) MONOMERS WITH AN ORTHOGONALLY PROTECTED ESTER MOIETY AND NOVEL INTERMEDIATES AND METHODS RELATED THERETO TRUCODE GENE REPAIR, INC. (US) 2019-01-24 WO disclosed
US-20180282375-A1 PEPTIDE NUCLEIC ACID (PNA) MONOMERS WITH AN ORTHOGONALLY PROTECTED ESTER MOIETY NEUBASE THERAPEUTICS, INC. 2018-10-04 US disclosed
WO-2018175927-A2 PEPTIDE NUCLEIC ACID (PNA) MONOMERS WITH AN ORTHOGONALLY PROTECTED ESTER MOIETY TRUCODE GENE REPAIR, INC. (US) 2018-09-27 WO disclosed