SCHEMBL2641504

SCHEMBL2641504

CCC(CC=CO)(CC=CO)CC=CO

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
SCHEMBL3101954 0.74
SCHEMBL1420447 0.73 ALDH1A1 (0.33)
SCHEMBL3104437 0.69
SCHEMBL11852700 0.67
SCHEMBL28123805 0.67 TRPA1 (0.30)
SCHEMBL9163817 0.67
SCHEMBL7580826 0.65
SCHEMBL11466998 0.64 MEN1 (0.48)
SCHEMBL11600974 0.64 TSHR (0.42)
SCHEMBL3404643 0.64 TSHR (0.30)

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
JP-4808610-B2 2011-11-02 JP claimed
US-20060204472-A1 Multifunctional dendrimers and hyperbranched polymers as drug and gene delivery systems PALEOS, CONSTANTINOS (GR) 2006-09-14 US claimed
EP-1603967-A1 MULTIFUNCTIONAL DENDRIMERS AND HYPERBRANCHED POLYMERS AS DRUG AND GENE DELIVERY SYSTEMS National Center for Scientific Research Demokritos (GR) 2005-12-14 EP claimed
WO-2004072153-A1 MULTIFUNCTIONAL DENDRIMERS AND HYPERBRANCHED POLYMERS AS DRUG AND GENE DELIVERY SYSTEMS NATIONAL CENTER FOR SCIENTIFIC RESEARCH 'DEMOKRITOS' (GR) 2004-08-26 WO claimed
US-20060204472-A1 Multifunctional dendrimers and hyperbranched polymers as drug and gene delivery systems PALEOS, CONSTANTINOS (GR) 2006-09-14 US disclosed
EP-1603967-A1 MULTIFUNCTIONAL DENDRIMERS AND HYPERBRANCHED POLYMERS AS DRUG AND GENE DELIVERY SYSTEMS National Center for Scientific Research Demokritos (GR) 2005-12-14 EP disclosed
WO-2004072153-A1 MULTIFUNCTIONAL DENDRIMERS AND HYPERBRANCHED POLYMERS AS DRUG AND GENE DELIVERY SYSTEMS NATIONAL CENTER FOR SCIENTIFIC RESEARCH 'DEMOKRITOS' (GR) 2004-08-26 WO disclosed