SCHEMBL7048965

SCHEMBL7048965

CC(N=C=O)C1(C(C)N=C=O)CCCCC1

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
SCHEMBL890430 0.77
SCHEMBL997453 0.73
SCHEMBL22609051 0.72
SCHEMBL28761778 0.68
SCHEMBL3261161 0.65
SCHEMBL11335493 0.65
SCHEMBL133094 0.65
SCHEMBL4799772 0.64
SCHEMBL3084511 0.64
SCHEMBL1795836 0.63

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
WO-2023238855-A1 TWO-COMPONENT MIXED POLYUREA RESIN COMPOSITION PRODUCTION RAW MATERIAL AND POLYUREA RESIN COMPOSITION ユニチカ株式会社 2023-12-14 WO disclosed
US-20230323010-A1 POLYURETHANE RESIN, NON-NATURAL LEATHER, AND INK MITSUI CHEMICALS, INC. (JP) 2023-10-12 US disclosed
EP-4206399-A1 POLYURETHANE RESIN, SYNTHETIC LEATHER, AND INK Mitsui Chemicals, Inc. (JP) 2023-07-05 EP disclosed
CN-116209807-A Polyurethane resin, synthetic leather-like and ink 三井化学株式会社 2023-06-02 CN disclosed
WO-2022045245-A1 POLYURETHANE RESIN, SYNTHETIC LEATHER, AND INK 三井化学株式会社 2022-03-03 WO disclosed
EP-3115430-B1 LAMINATE ADHESIVE, METHOD FOR MANUFACTURING LAMINATE FILM, LAMINATE FILM, AND RETORT POUCH MATERIAL MITSUI CHEMICALS INC (JP) 2020-08-05 EP disclosed
WO-2019189944-A1 ALIPHATIC AND/OR ALICYCLIC POLYURETHANE UREA RESIN AND METHOD FOR PREPARING SAME 株式会社ウェルグリーン 2019-10-03 WO disclosed
US-20170066949-A1 LAMINATE ADHESIVE, METHOD FOR PRODUCING LAMINATE FILM, LAMINATE FILM, AND RETORT POUCH MATERIAL MITSUI CHEMICALS, INC. (JP) 2017-03-09 US disclosed
EP-3115430-A1 LAMINATE ADHESIVE, METHOD FOR MANUFACTURING LAMINATE FILM, LAMINATE FILM, AND RETORT POUCH MATERIAL Mitsui Chemicals, Inc. (JP) 2017-01-11 EP disclosed
EP-1078944-B1 Process for manufacturing thermoplastic polyurethane fibres BASF AG (DE) 2003-04-09 EP disclosed
US-4456744-A ISOCYANATE COMPONENT CONTAINING OXADIAZINETRIONE RING AND POLYOL HAVING TERTIARY AMINO, QUATERNARY AMMONIUM GROUP OR SALT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-06-26 US disclosed
US-4448947-A POLYETHEURETHANE COPOLYMER; ONE ISOCYANATE HAVING OXADIAZINE-2,4,6-TRIONE RING TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-05-15 US disclosed
US-4443590-A ISOCYANATE COMPONENT HAVING OXADIAZINETRIONE RING, ACTIVE HYDROGEN COMPONENT, LEWIS BASE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-04-17 US disclosed
US-4412072-A STABILIZED WITH A PEROXIDE, SULFUR, POLYSULFIDE, METAL SULFIDE OR A HALOGEN TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1983-10-25 US disclosed
EP-0085776-A1 Novel composition for polyurethane resins Takeda Chemical Industries, Ltd. (JP) 1983-08-17 EP disclosed
EP-0081693-A1 Two-package type pressure-sensitive adhesive composition Takeda Chemical Industries, Ltd. (JP) 1983-06-22 EP disclosed
EP-0081713-A2 One-pack type thermosetting polyurethane coating composition Takeda Chemical Industries, Ltd. (JP) 1983-06-22 EP disclosed
EP-0081103-A1 One-can type pressure-sensitive adhesive composition Takeda Chemical Industries, Ltd. (JP) 1983-06-15 EP disclosed
EP-0068454-A1 Composition for polyurethane resins and production of the resins Takeda Chemical Industries, Ltd. (JP) 1983-01-05 EP disclosed
EP-0042701-A2 Isocyanate composition Takeda Chemical Industries, Ltd. (JP) 1981-12-30 EP disclosed