SCHEMBL6465652

SCHEMBL6465652

CC(C)C[C@@](C)(C#N)N=NC(C)(C)C

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
SCHEMBL481560 1.00
SCHEMBL481559 1.00
SCHEMBL14897 0.93
SCHEMBL26739247 0.93
SCHEMBL27970435 0.93
SCHEMBL14898 0.93
Hydrochloric Acid SCHEMBL9811924 0.91
Hydrochloric Acid SCHEMBL9811927 0.91
Hydrogen Peroxide SCHEMBL11529670 0.89
Methyl Alcohol SCHEMBL27889911 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6432543-B1 None US disclosed
US-6852403-B2 Decorative components having an elastomeric outer surface and methods of making such components BASF CORPORATION (US) 2005-02-08 US disclosed
US-20040058165-A1 Decorative components having an elastomeric outer surface and methods of making such components HARRISON RICHARD P (US) 2004-03-25 US disclosed
US-6649107-B2 Aromatic polyurethane elastomers for making objects in a mold cavity BASF CORPORATION 2003-11-18 US disclosed
US-20020192452-A1 Decorative components having an elastomeric outer surface and methods of making such components BASF CORPORATION 2002-12-19 US disclosed
US-6432543-B2 AROMATIC POLYURETHANE ELASTOMER BASF CORPORATION 2002-08-13 US disclosed
US-6352658-B1 MULTILAYER; EXTERIOR DECORATIVE ELASTOMER; INTERIOR FOAM;POLYURETHANES BASF CORPORATION 2002-03-05 US disclosed
US-20020001722-A1 DECORATIVE COMPONENTS HAVING AN ELASTOMERIC OUTER SURFACE AND METHODS OF MAKING SUCH COMPONENTS BASF CORPORATION 2002-01-03 US disclosed
EP-1112838-A1 Decorative components having an elastomeric outer surface and methods of making such components BASF CORPORATION (US) 2001-07-04 EP disclosed