SCHEMBL3302565

SCHEMBL3302565

C=CCN1C=NC=CC1

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
Water SCHEMBL9017155 0.98
SCHEMBL2059958 0.72
SCHEMBL2230207 0.71
SCHEMBL27639 0.67
SCHEMBL7171752 0.67
SCHEMBL618855 0.66
SCHEMBL2327848 0.65 GBA2 (0.31)
SCHEMBL11405636 0.65
SCHEMBL11256726 0.65
SCHEMBL82843 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0262344-B1 N-alkylated quaternary nitrogen-containing heterocycles, process for their preparation and their use in pharmaceutical compositions PUETTER MEDICE CHEM PHARM (DE) 1996-03-27 EP claimed
US-4929723-A Process for preparing 2-deoxynucleosides ETHYL CORPORATION (US) 1990-05-29 US claimed
EP-0300765-A2 Process for preparing 2-deoxynucleosides ETHYL CORPORATION (US) 1989-01-25 EP claimed
JP-1061495-A None JP disclosed
US-20180066009-A1 Nucleosides and Oligonucleotides for Studies on Reversal of Cytotoxic and Mutagenic Damage of DNA and as Diagnostics Tools CHEMGENES CORP (US) 2018-03-08 US disclosed
US-9718855-B2 Nucleosides and oligonucleotides for studies on reversal of cytotoxic and mutagenic damage of DNA and as diagnostics tools CHEMGENES CORPORATION (US) 2017-08-01 US disclosed
EP-2958181-B1 NON-AQUEOUS ELECTROLYTIC SOLUTION AND NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEM CORP (JP) 2017-06-14 EP disclosed
US-9653754-B2 Nonaqueous electrolytes and nonaqueous-electrolyte secondary batteries employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2017-05-16 US disclosed
US-9620814-B2 2017-04-11 US disclosed
US-9515348-B2 Nonaqueous electrolytic solution and nonaqueous-electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-12-06 US disclosed
US-9231277-B2 Nonaqueous electrolytes and nonaqueous-electrolyte secondary batteries employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2016-01-05 US disclosed
EP-0752987-A1 PYRIMIDINYL DERIVATIVES AS INTERLEUKIN INHIBITORS SANOFI WINTHROP, INC. (US) 1997-01-15 EP disclosed
WO-1995026958-A1 PYRIMIDINYL DERIVATIVES AS INTERLEUKIN INHIBITORS SANOFI WINTHROP, INC. (US) 1995-10-12 WO disclosed
US-4929723-A Process for preparing 2-deoxynucleosides ETHYL CORPORATION (US) 1990-05-29 US disclosed
US-4929723-A Process for preparing 2-deoxynucleosides ETHYL CORPORATION (US) 1990-05-29 US disclosed
EP-0300765-A2 Process for preparing 2-deoxynucleosides ETHYL CORPORATION (US) 1989-01-25 EP disclosed
US-4229343-A Azo dyes from an oxadiazolyl-substituted aniline BASF AKTIENGESELLSCHAFT (DE) 1980-10-21 US disclosed
US-4177190-A Diamino-androstanes and a process for the preparation of the said compounds RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1979-12-04 US disclosed
US-4101545-A NEUROMUSCULAR BLOCKING AGENTS RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1978-07-18 US disclosed
US-4016151-A Phenyl-substituted phthalazone azo dyes with a coupling component of the phenol, napthol, acetoacetarylide, pyrazolone, quinolone, pyridine, pyrimidone or isoquinolone series BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1977-04-05 US disclosed