SCHEMBL812404

SCHEMBL812404

O=C=NCSC(CN=C=O)SCN=C=O

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
SCHEMBL3097894 0.82
SCHEMBL7525997 0.76
SCHEMBL7522880 0.76
Propynoic Acid Ethyl Ester SCHEMBL7903899 0.76
SCHEMBL30118085 0.74
SCHEMBL7526930 0.73
SCHEMBL330877 0.72
SCHEMBL7910630 0.70
SCHEMBL812945 0.69
SCHEMBL812788 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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0976727-B1 Polyisocyanate compound, process for producing the same and optical resin materials using the same HOYA CORP (JP) 2003-01-15 EP claimed
US-6194603-B1 FOR PRODUCING POLY(THIO)URETHANES; FOR LENSES; REFRACTIVE INDEX, LOW DIEPERSION HOYA CORPORATION (JP) 2001-02-27 US claimed
EP-0976727-A1 Polyisocyanate compound, process for producing the same and optical resin materials using the same HOYA CORPORATION (JP) 2000-02-02 EP claimed
US-12287450-B2 Functional laminate and functional lens comprising the functional laminate TOKUYAMA CORPORATION (JP) 2025-04-29 US disclosed
US-20240241291-A1 FUNCTIONAL LAMINATE AND FUNCTIONAL LENS COMPRISING THE FUNCTIONAL LAMINATE TOKUYAMA CORPORATION (JP) 2024-07-18 US disclosed
US-11988808-B2 Functional laminate and functional lens comprising the functional laminate TOKUYAMA CORPORATION (JP) 2024-05-21 US disclosed
EP-3757663-A1 FUNCTIONAL MULTILAYER BODY AND FUNCTIONAL LENS USING FUNCTIONAL MULTILAYER BODY Tokuyama Corporation (JP) 2020-12-30 EP disclosed
US-20200386915-A1 FUNCTIONAL LAMINATE AND FUNCTIONAL LENS COMPRISING THE FUNCTIONAL LAMINATE TOKUYAMA CORPORATION (JP) 2020-12-10 US disclosed
EP-2390290-B1 Ink jet recording ink composition SEIKO EPSON CORP (JP) 2016-11-16 EP disclosed
US-8613509-B2 Ink jet recording ink composition SEIKO EPSON CORPORATION (JP) 2013-12-24 US disclosed
EP-2390290-A1 Ink jet recording ink composition Seiko Epson Corporation (JP) 2011-11-30 EP disclosed
US-20110257646-A1 Method for treating fecal incontinence MEDERI THERAPEUTICS INC. 2011-10-20 US disclosed
EP-1378535-B1 POLYMERIZATION REGULATORS AND COMPOSITIONS FOR RESIN MITSUBISHI GAS CHEMICAL CO (JP) 2009-11-11 EP disclosed
US-7446163-B2 Polymerization regulator and composition for resin MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2008-11-04 US disclosed
US-7169845-B2 Polymerization regulators and compositions for resin MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2007-01-30 US disclosed
US-20050261467-A1 Polymerization regulator and composition for resin TAMURA MASAKI 2005-11-24 US disclosed
EP-1378535-A1 POLYMERIZATION REGULATORS AND COMPOSITIONS FOR RESIN MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-01-07 EP disclosed
EP-0976727-B1 Polyisocyanate compound, process for producing the same and optical resin materials using the same HOYA CORP (JP) 2003-01-15 EP disclosed
US-6194603-B1 FOR PRODUCING POLY(THIO)URETHANES; FOR LENSES; REFRACTIVE INDEX, LOW DIEPERSION HOYA CORPORATION (JP) 2001-02-27 US disclosed
EP-0976727-A1 Polyisocyanate compound, process for producing the same and optical resin materials using the same HOYA CORPORATION (JP) 2000-02-02 EP disclosed