SCHEMBL1368680

SCHEMBL1368680

CCCOCC(Br)Br

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
SCHEMBL28197424 0.83
SCHEMBL5277347 0.80 ALDH1A1 (0.39)
SCHEMBL28789940 0.80
SCHEMBL5278601 0.78 ALDH1A1 (0.38)
SCHEMBL15059128 0.78 ALDH1A1 (0.38)
SCHEMBL28324719 0.78 ALDH1A1 (0.38)
SCHEMBL11297200 0.78 ALDH1A1 (0.38)
SCHEMBL7848246 0.75
SCHEMBL567347 0.74
SCHEMBL1778962 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8512862-B2 Polyvinyl formamide (PNVF) and polyvinyl amine (PVAm)nanoparticles, nanocapsules and nanogels UNIVERSITY OF KANSAS (US) 2013-08-20 US disclosed
US-20110287262-A1 NANOPARTICLES, NANOCAPSULES AND NANOGELS UNIVERSITY OF KANSAS 2011-11-24 US disclosed
US-7993749-B2 Shell of poly(N-vinyl formamide) crosslinked to polyvinyl amine with 2-bis[2,2'-di(N-vinylformamido)ethoxy]propane on a silica particle template UNIVERSITY OF KANSAS (US) 2011-08-09 US disclosed
US-20080075667-A1 Shell of poly(N-vinyl formamide) crosslinked to polyvinyl amine with 2-bis[2,2'-di(N-vinylformamido)ethoxy]propane on a silica particle template KANSAS, UNIVERSITY OF 2008-03-27 US disclosed