SCHEMBL5819702

SCHEMBL5819702

CC1(C)OOC(C)(C)O1

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
SCHEMBL5945099 0.78
SCHEMBL19921920 0.78
SCHEMBL3107279 0.78
SCHEMBL37682 0.72
SCHEMBL7948270 0.67
SCHEMBL13345009 0.60
SCHEMBL12128853 0.60
SCHEMBL1024758 0.60
SCHEMBL12069387 0.59
SCHEMBL6569977 0.56

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160221905-A1 Methods and Systems for Generating Aldehydes from Organic Seed Oils Colorado Energy Research Technologies, LLC 2016-08-04 US disclosed
US-8444950-B2 Polymer carbon nanotube composites NANOLEDGE INC. (CA) 2013-05-21 US disclosed
US-20110046316-A1 POLYMER CARBON NANOTUBE COMPOSITES AXSON SERVICES GMBH (CH) 2011-02-24 US disclosed
US-20100254928-A1 NOVEL COMPOSITION CONTAINING OZONIZED SURFACTANT ERC TECHNOLOGY INC. (JP) 2010-10-07 US disclosed
US-20100254928-A1 NOVEL COMPOSITION CONTAINING OZONIZED SURFACTANT ERC TECHNOLOGY INC. (JP) 2010-10-07 US disclosed
EP-2213165-A1 NOVEL COMPOSITIONS CONTAINING OZONIZED SURFACTANT Erc Technology Inc. (JP) 2010-08-04 EP disclosed
US-20100041903-A1 Ozonized Surfactant ERC TECHNOLOGY INC. 2010-02-18 US disclosed
US-20100041903-A1 Ozonized Surfactant ERC TECHNOLOGY INC. 2010-02-18 US disclosed
EP-2033999-A1 OZONIZED SURFACTANT Erc Technology Inc. (JP) 2009-03-11 EP disclosed
WO-2006125669-A1 COLD-BOX BINDER SYSTEM USING SATURATED FATTY ACID ESTERS ASHLAND SÜDCHEMIE-KERNFEST GMBH (DE) 2006-11-30 WO disclosed