SCHEMBL5880710

SCHEMBL5880710

CCCC(CC)C1(C(=O)OC(C)(C)CC)OO1

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
SCHEMBL8614971 0.88
SCHEMBL455155 0.87 CTSK (0.33)
SCHEMBL5880707 0.85
SCHEMBL425862 0.73
SCHEMBL3396903 0.72 CHRM1 (0.38)
SCHEMBL8836331 0.72
SCHEMBL9562906 0.72 CYP3A4 (0.35)
SCHEMBL16042469 0.71 CTSK (0.32)
SCHEMBL9566592 0.69 CTSK (0.36)
SCHEMBL728140 0.68 CA2 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-10158496-A None JP disclosed
US-20200140590-A1 RESIN FOR UNIVERSAL SOLVENTBORNE PIGMENT DISPERSION SWIMC LLC (US) 2020-05-07 US disclosed
EP-3615582-A1 RESIN FOR UNIVERSAL SOLVENTBORNE PIGMENT DISPERSION SWIMC LLC (US) 2020-03-04 EP disclosed
WO-2018200057-A1 RESIN FOR UNIVERSAL SOLVENTBORNE PIGMENT DISPERSION SWIMC, LLC (US) 2018-11-01 WO disclosed
US-20180305485-A1 RESIN FOR UNIVERSAL SOLVENTBORNE COLORANTS THE SHERWIN-WILLIAMS COMPANY (US) 2018-10-25 US disclosed
US-7109262-B2 Effect-producing, aqueous coating material, method for the production and use thereof BASF COATINGS AG (DE) 2006-09-19 US disclosed
US-20050004265-A1 Effect-producing, aqueous coating material, method for the production and use thereof BASF COATINGS AKTIENGESELLSCHAFT (DE) 2005-01-06 US disclosed
US-6607788-B1 (Meth)acrylate dispersion with polyurethane and rheological assitant; automobiles BASF COATINGS AG (DE) 2003-08-19 US disclosed
US-6403701-B1 PIGMENT, AN ORGANIC SOLVENT AND A FIRST BINDER, PIGMENT-FREE AQUEOUS COMPONENT INCLUDES WATER AND A SECOND BINDER; IMPROVED CONDENSATION RESISTANCE; PRECISELY DEFINED TINTING FROM VARIOUS BASE COLORS; REPAIRING DAMAGED AREAS BASF COATINGS AG (DE) 2002-06-11 US disclosed
US-6162506-A Aqueous coating materials and methods of making and using same BASF COATINGS AG (DE) 2000-12-19 US disclosed
US-6001424-A ETHYLENICALLY UNSATURATED MONOMER OR A MIXTURE OF ETHYLENICALLY UNSATURATED MONOMERS TO FREE-RADICAL POLYMERIZATION IN AN AQUEOUS DISPERSION OF A POLYURETHANE RESIN BASF LACKE + FARBEN AKTIENGESELLSCHAFT (DE) 1999-12-14 US disclosed
JP-H10158496-A UNSATURATED POLYESTER RESIN COMPOSITION SEKISUI CHEM CO LTD 1998-06-16 JP disclosed
US-5447676-A Low-pressure and low-temperature moldable composition and shaped article therefrom TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-09-05 US disclosed
US-5432221-A Polymer of vinyltoluene, lauryl or stearyl methacrylate, hydroxypropyl methacrylate or acrylate; curable composition of the polymer, a polyisocyanate, and, optionally, castor oil THE SHERWIN-WILLIAMS COMPANY (US) 1995-07-11 US disclosed
EP-0598227-A1 Low-pressure and low-temperature moldable composition and shaped article therefrom TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-05-25 EP disclosed