SCHEMBL1117366

SCHEMBL1117366

CCCCC(C)(N)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
SCHEMBL18109472 1.00
SCHEMBL15630950 1.00
Hydrochloric Acid SCHEMBL18109660 0.97 FDPS (0.41)
Hydrochloric Acid SCHEMBL18109663 0.97 FDPS (0.41)
SCHEMBL1117649 0.92 FDPS (0.45)
SCHEMBL18109424 0.92 FDPS (0.45)
SCHEMBL1117431 0.90 FDPS (0.47)
SCHEMBL1117370 0.90 FDPS (0.47)
SCHEMBL1117558 0.90 FDPS (0.47)
SCHEMBL1117533 0.90 FDPS (0.47)

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 144 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3135109-B1 AMINOALCOHOL AND BIOCIDE COMPOSITIONS FOR AQUEOUS BASED SYSTEMS ANGUS CHEMICAL (US) 2020-02-12 EP claimed
US-9890177-B2 Nitrated hydrocarbons, derivatives, and processes for their manufacture ANGUS CHEMICAL COMPANY (US) 2018-02-13 US claimed
EP-3135109-A1 AMINOALCOHOL AND BIOCIDE COMPOSITIONS FOR AQUEOUS BASED SYSTEMS ANGUS Chemical Company (US) 2017-03-01 EP claimed
EP-3121162-A1 NITRATED HYDROCARBONS AND DERIVATIVES ANGUS CHEMICAL COMPANY (US) 2017-01-25 EP claimed
EP-2282634-B1 AMINOALCOHOL AND BIOCIDE COMPOSITIONS FOR AQUEOUS BASED SYSTEMS ANGUS CHEMICAL (US) 2016-11-23 EP claimed
US-20160039843-A1 NITRATED HYDROCARBONS, DERIVATIVES, AND PROCESSES FOR THEIR MANUFACTURE ADVANCION CORPORATION 2016-02-11 US claimed
CN-102026542-B Aminoalcohol and biocide compositions for aqueous based systems ANGUS CHEMICAL 2014-08-20 CN claimed
US-8697754-B2 Aminoalcohol and biocide compositions for aqueous based systems DOW GLOBAL TECHNOLOGIES LLC 2014-04-15 US claimed
CN-102026542-A Aminoalcohol and biocide compositions for aqueous based systems ANGUS CHEMICAL 2011-04-20 CN claimed
CN-102026541-A Improved corrosion and microbial control in hydrocarbonaceous compositions ANGUS CHEMICAL 2011-04-20 CN claimed
EP-2299811-A1 IMPROVED CORROSION AND MICROBIAL CONTROL IN HYDROCARBONACEOUS COMPOSITIONS ANGUS CHEMICAL COMPANY (US) 2011-03-30 EP claimed
CN-101998948-A Nitrated hydrocarbons, derivatives and processes for their manufacture DOW GLOBAL TECHNOLOGIES INCANGUS CHEMICAL COMPANY 2011-03-30 CN claimed
US-20110041387-A1 CORROSION AND MICROBIAL CONTROL IN HYDROCARBONACEOUS COMPOSITIONS ADVANCION CORPORATION 2011-02-24 US claimed
US-20110046140-A1 AMINOALCOHOL AND BIOCIDE COMPOSITIONS FOR AQUEOUS BASED SYSTEMS ADVANCION CORPORATION 2011-02-24 US claimed
EP-2282634-A2 AMINOALCOHOL AND BIOCIDE COMPOSITIONS FOR AQUEOUS BASED SYSTEMS ANGUS CHEMICAL COMPANY (US) 2011-02-16 EP claimed
EP-2280927-A1 NITRATED HYDROCARBONS, DERIVATIVES, AND PROCESSES FOR THEIR MANUFACTURE ANGUS CHEMICAL COMPANY (US) 2011-02-09 EP claimed
US-20110028732-A1 NITRATED HYDROCARBONS, DERIVATIVES, AND PROCESSES FOR THEIR MANUFACTURE ANGUS CHEMICAL COMPANY (US) 2011-02-03 US claimed
WO-2009140062-A1 IMPROVED CORROSION AND MICROBIAL CONTROL IN HYDROCARBONACEOUS COMPOSITIONS ANGUS CHEMICAL COMPANY (US) 2009-11-19 WO claimed
WO-2009140061-A2 AMINOALCOHOL AND BIOCIDE COMPOSITIONS FOR AQUEOUS BASED SYSTEMS ANGUS CHEMICAL COMPANY (US) 2009-11-19 WO claimed
WO-2009129097-A1 NITRATED HYDROCARBONS, DERIVATIVES, AND PROCESSES FOR THEIR MANUFACTURE ANGUS CHEMICAL COMPANY (US) 2009-10-22 WO claimed