SCHEMBL5087641

SCHEMBL5087641

CC(C)(C)CC(Cl)(Cl)Cl

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
SCHEMBL5720348 0.75
SCHEMBL42164 0.75
SCHEMBL19381 0.75
SCHEMBL9183026 0.72 TSHR (0.36)
SCHEMBL83729 0.71
SCHEMBL392874 0.71
SCHEMBL2456516 0.69
SCHEMBL4466461 0.69
SCHEMBL11022588 0.69 ALDH1A1 (0.33)
SCHEMBL2457037 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109134716-B Vanadium catalyst and method for preparing olefin polymer 北京引发科技有限公司 2020-11-10 CN claimed
CN-114685505-A Imidazopyrrolopyridines as JAK family kinase inhibitors 詹森药业有限公司 2022-07-01 CN disclosed
CN-110312719-B Imidazopyrrolopyridines as JAK family kinase inhibitors 詹森药业有限公司 2022-04-15 CN disclosed
US-11203573-B2 N-alkylation of acridans SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2021-12-21 US disclosed
US-20210230119-A1 N-ALKYLATION OF ACRIDANS SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2021-07-29 US disclosed
CN-109134716-B Vanadium catalyst and method for preparing olefin polymer 北京引发科技有限公司 2020-11-10 CN disclosed
US-20190161461-A1 RIBONUCLEOTIDE REDUCTASE INHIBITORS AND METHODS OF USE CITY OF HOPE 2019-05-30 US disclosed
US-20180155303-A1 RIBONUCLEOTIDE REDUCTASE INHIBITORS AND METHODS OF USE CITY OF HOPE 2018-06-07 US disclosed
US-9796692-B2 Ribonucleotide reductase inhibitors and methods of use CITY OF HOPE (US) 2017-10-24 US disclosed
US-20170137392-A1 RIBONUCLEOTIDE REDUCTASE INHIBITORS AND METHODS OF USE CITY OF HOPE 2017-05-18 US disclosed
WO-2008015714-A2 PROCESS FOR THE PREPARATION OF 1,1-DICHLORO-2-ALKYLETHYLENE F.I.S. FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2008-02-07 WO disclosed
WO-2008015714-A2 PROCESS FOR THE PREPARATION OF 1,1-DICHLORO-2-ALKYLETHYLENE F.I.S. FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2008-02-07 WO disclosed
US-7223769-B2 Pyrimidine compounds and their use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-29 US disclosed
EP-1483249-B1 PYRIMIDINE DERIVATIVES AND THEIR USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2006-09-06 EP disclosed
US-20050171130-A1 Pyrimidine compounds and their use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-08-04 US disclosed
EP-0163433-B1 ANTIBACTERIAL SOLID COMPOSITION FOR ORAL ADMINISTATION Takeda Chemical Industries, Ltd. (JP) 1990-08-01 EP disclosed
US-4616008-A LIPID-SOLUBLE CEPHALOSPORINS AND CYCLODEXTRINS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-10-07 US disclosed
EP-0163433-A2 Antibacterial solid composition for oral administation Takeda Chemical Industries, Ltd. (JP) 1985-12-04 EP disclosed
EP-0035357-A1 2-Methylcephalosporins and production thereof Takeda Chemical Industries, Ltd. (JP) 1981-09-09 EP disclosed
US-4112086-A BACTERICIDE SMITHKLINE CORPORATION (US) 1978-09-05 US disclosed