SCHEMBL3600520

SCHEMBL3600520

CCC(C#N)C=C(C)C(=O)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
SCHEMBL6049401 0.85 CHRM1 (0.34)
SCHEMBL74357 0.74 GRIK1 (0.31)
SCHEMBL74358 0.74 GRIK1 (0.31)
SCHEMBL1543776 0.72 PTGS1 (0.30)
SCHEMBL27805093 0.72 GRIK1 (0.31)
SCHEMBL1000711 0.72 PTGS1 (0.32)
SCHEMBL9767228 0.72 PTGS1 (0.32)
SCHEMBL9231077 0.72 PTGS1 (0.32)
SCHEMBL11360502 0.70 ALDH1A1 (0.32)
SCHEMBL8764559 0.70 ALDH1A1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9388302-B2 Latex for dip molding, composition for dip molding, preparation method of dip molded product, and dip molded product prepared thereby LG CHEM, LTD. (KR) 2016-07-12 US disclosed
US-20150352747-A1 BLADDER FOR TIRE VULCANIZATION DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2015-12-10 US disclosed
US-20140329956-A1 LATEX FOR DIP MOLDING, COMPOSITION FOR DIP MOLDING, PREPARATION METHOD OF DIP MOLDED PRODUCT, AND DIP MOLDED PRODUCT PREPARED THEREBY LG CHEMICAL LTD (KR) 2014-11-06 US disclosed
US-20130295209-A1 TIRE BLADDER DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2013-11-07 US disclosed
US-20130090424-A1 ACRYLIC RUBBER COMPOSITION, VULCANIZATE, HOSE PART, AND SEALING PART DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2013-04-11 US disclosed
US-7662890-B2 Composition for dip forming and molding obtained by dip forming ZEON CORPORATION (JP) 2010-02-16 US disclosed
US-20070149693-A1 Composition for dip forming and molding obtained by dip forming ZEON CORPORATION (JP) 2007-06-28 US disclosed