SCHEMBL3348967

SCHEMBL3348967

CC(CCN=C=O)C(C)C(C)CN=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
SCHEMBL8764111 0.77
SCHEMBL2780467 0.77 TRPA1 (0.33)
SCHEMBL1072173 0.76
SCHEMBL5508848 0.75
SCHEMBL17264976 0.74
SCHEMBL8016571 0.72
SCHEMBL3843212 0.72
SCHEMBL231391 0.72
SCHEMBL1899523 0.71
SCHEMBL21175630 0.70

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6389602-B1 POLYETHERURETHANE COPOLYMER LRC PRODUCTS LIMITED (GB) 2002-05-21 US claimed
US-9318776-B2 Nonaqueous electrolyte solution and electricity storage device using same UBE INDUSTRIES, LTD. (JP) 2016-04-19 US disclosed
US-9318776-B2 Nonaqueous electrolyte solution and electricity storage device using same UBE INDUSTRIES, LTD. (JP) 2016-04-19 US disclosed
EP-2771315-B1 METHOD FOR PREPARING A COMPOUND COMPRISING AT LEAST ONE beta-HYDROXY-URETHANE UNIT AND/OR AT LEAST ONE gamma-HYDROXY-URETHANE UNIT SOCIÉTÉ D EXPL GÉNÉRALE DE PRODUITS IND S E G SAS (FR) 2016-04-13 EP disclosed
US-20150333370-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD. (JP) 2015-11-19 US disclosed
US-20150333370-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD. (JP) 2015-11-19 US disclosed
EP-2889947-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE USING SAME UBE Industries, Ltd. (JP) 2015-07-01 EP disclosed
US-20140378648-A1 METHOD FOR PREPARING A COMPOUND COMPRISING AT LEAST ONE BETA-HYDROXY-URETHANE UNIT AND/OR AT LEAST ONE UPSILON-HYDROXY-URETHANE UNIT SOULES AURÉLIEN (FR) 2014-12-25 US disclosed
CN-101984758-B Resin composition for a high refractive index optical lens having superior impact resistance, high refractive index optical lens using same, and method for producing same KOC SOLUTION CO LTD 2013-02-20 CN disclosed
CN-101984758-A Resin composition for a high refractive index optical lens having superior impact resistance, high refractive index optical lens using same, and method for producing same KOC SOLUTION CO LTD 2011-03-09 CN disclosed
US-7709058-B2 Process for coating metal sheet, especially zinc sheet HENKEL KGAA (DE) 2010-05-04 US disclosed
US-20080026233-A1 PROCESS FOR COATING METAL SHEET, ESPECIALLY ZINC SHEET HENKEL AG & CO. KGAA (DE) 2008-01-31 US disclosed
US-6389602-B1 POLYETHERURETHANE COPOLYMER LRC PRODUCTS LIMITED (GB) 2002-05-21 US disclosed
WO-1992013906-A1 PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS SUITABLE FOR MEDICAL USES BIOINTERFACE TECHNOLOGIES, INC. (US) 1992-08-20 WO disclosed
US-5045601-A Wound Dressings BIOINTERFACE TECHNOLOGIES, INC. (US) 1991-09-03 US disclosed
EP-0373671-A2 Waterborne polyurethane dispersions SANNCOR INDUSTRIES, INC. (US) 1990-06-20 EP disclosed
US-4720398-A Process for the improvement of the adhesion to rubber or a thermoplastic elastomer of synthetic yarns, cords or fabrics made therefrom AKZO NV (NL) 1988-01-19 US disclosed
EP-0168066-A1 Process for the improvement of the adhesion to rubber or a thermoplastic elastomer of synthetic yarns, cords or fabrics made therefrom AKZO N.V. (NL) 1986-01-15 EP disclosed