SCHEMBL1825864

SCHEMBL1825864

CC1(C)N=C(CCSCCSCCC2=NC(C)(C)C(=O)O2)OC1=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
SCHEMBL1827415 0.89
SCHEMBL11091066 0.87
SCHEMBL7752813 0.84 TP53 (0.31)
SCHEMBL12756282 0.80
SCHEMBL7752907 0.79
SCHEMBL6699147 0.79
SCHEMBL5677487 0.77
SCHEMBL6698827 0.76 TP53 (0.31)
SCHEMBL6252507 0.74
SCHEMBL2494925 0.74 CDC25B (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1794213-B1 SUBSTRATE WITH ATTACHED DENDRIMERS 3M INNOVATIVE PROPERTIES CO (US) 2011-05-04 EP disclosed
US-7556858-B2 Substrate with attached dendrimers 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-07-07 US disclosed
EP-1794213-A1 SUBSTRATE WITH ATTACHED DENDRIMERS 3M Innovative Properties Company (US) 2007-06-13 EP disclosed
WO-2006039052-A1 SUBSTRATE WITH ATTACHED DENDRIMERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-04-13 WO disclosed
US-20060068204-A1 Substrate with attached dendrimers 3M INNOVATIVE PROPERTIES COMPANY 2006-03-30 US disclosed
EP-0105665-B1 AZLACTONE-FUNCTIONAL COMPOUNDS AND CURABLE COMPOSITIONS CONTAINING SAME MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1987-12-02 EP disclosed
US-4639286-A Curable compositions containing azlactone-functional compounds MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1987-01-27 US disclosed
US-4485236-A NUCLEOPHILIC GROUP SUBSTITUTION; CROSSLINKED POLYAMIDE RESIN SYSTEMS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-11-27 US disclosed