SCHEMBL442015

SCHEMBL442015

O=C(Br)CI

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
SCHEMBL25236477 0.72
SCHEMBL10835157 0.70
Cyclohexane SCHEMBL28364673 0.67 TSHR (0.44)
SCHEMBL12855625 0.67
SCHEMBL689143 0.67
SCHEMBL5468344 0.67
SCHEMBL34263 0.67
SCHEMBL1890794 0.67
SCHEMBL4605068 0.67
SCHEMBL689061 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101973971-A Method for preparing 5-halogenated ethyl-2,3-dihydrobenzofuran SHANDONG ZHOUPING DAZHAN NEW MATERIAL CO LTD 2011-02-16 CN claimed
US-5539083-A FROM HALOACETYL HALIDE OR SULFONYLACETYL HALIDE, PROTECTED ALKYLENEDIAMINE, AND A DERIVATIVE OF A NUCLEIC ACID BASE ISIS PHARMACEUTICALS, INC. (US) 1996-07-23 US claimed
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
EP-1010684-A1 PROCESS FOR PRODUCING 3,4-DIHYDROXY-3-CYCLOBUTENE-1,2-DIONE Kyowa Yuka Co., Ltd. (JP) 2000-06-21 EP disclosed
EP-0777678-B1 PNA COMBINATORIAL LIBRARIES AND IMPROVED METHODS OF SYNTHESIS ISIS PHARMACEUTICALS INC (US) 1999-10-13 EP disclosed
US-5864010-A ENZYME INHIBITOR; ANTIINFLAMMATORY AGENT ISIS PHARMACEUTICALS, INC. (US) 1999-01-26 US disclosed
US-5831014-A OLIGOMERS WITH PEPTIDE NUCLEIC ACID UNITS AND AMINO ACID UNITS ISIS PHARMACEUTICALS, INC. (US) 1998-11-03 US disclosed
EP-0777678-A4 1997-07-16 EP disclosed
EP-0777678-A1 PNA COMBINATORIAL LIBRARIES AND IMPROVED METHODS OF SYNTHESIS ISIS PHARMACEUTICALS, INC. (US) 1997-06-11 EP disclosed
US-5539083-A FROM HALOACETYL HALIDE OR SULFONYLACETYL HALIDE, PROTECTED ALKYLENEDIAMINE, AND A DERIVATIVE OF A NUCLEIC ACID BASE ISIS PHARMACEUTICALS, INC. (US) 1996-07-23 US disclosed
WO-1995023163-A1 PNA COMBINATORIAL LIBRARIES AND IMPROVED METHODS OF SYNTHESIS ISIS PHARMACEUTICALS, INC. (US) 1995-08-31 WO disclosed
US-4402734-A N-(HALOALKYL)-N-(CARBOXYALKYL)ANILINE DERIVATIVE SUMITOMO CHEMICAL CO., LTD. (JP) 1983-09-06 US disclosed