SCHEMBL7787555

SCHEMBL7787555

C[CH]OC(=O)C(C)Cl

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
SCHEMBL11046895 0.81
SCHEMBL445941 0.78
SCHEMBL480449 0.77
SCHEMBL22556015 0.76
SCHEMBL10470528 0.74
SCHEMBL8924849 0.74
SCHEMBL10904895 0.72
Acetic Acid SCHEMBL27669538 0.72 TSHR (0.33)
SCHEMBL4396526 0.72 TSHR (0.32)
SCHEMBL952090 0.71 TSHR (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4542207-A Heterocyclic monoazo dyes for polyester fibers RESEARCH ASSOCIATION OF SYNTHETIC DYESTUFFS (JP) 1985-09-17 US claimed
EP-0667376-B1 Phtalimidyl azo dyes, process for their preparation and their use CIBA SC HOLDING AG (CH) 2001-11-14 EP disclosed
US-6008332-A DISPERSE AZO DYES CONTAINING A N-METHYLPHTHALIMIDE DIAZO COMPONENT AND AN ANILINE COUPLING COMPONENT; DYEING SEMISYNTHETIC OR SYNTHETIC HYDROPHOBIC FIBERS, SUCH AS POLYESTER TEXTILES; COLORFASTNESS, WASHFASTNESS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-12-28 US disclosed
EP-0667376-A1 Phtalimidyl azo dyes, process for their preparation and their use CIBA-GEIGY AG (CH) 1995-08-16 EP disclosed
US-4895587-A Haloacetamide compounds, process for production thereof, and use thereof as herbicide TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1990-01-23 US disclosed
US-4841036-A COLORFAST, HEAT RESISTANCE MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) 1989-06-20 US disclosed
US-4837309-A IMPROVED COLORFASTNESS AND LIGHTFASTNESS MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1989-06-06 US disclosed
EP-0206251-B1 HALOACETAMIDE COMPOUNDS, PROCESS FOR PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDE TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1988-09-07 EP disclosed
EP-0206251-A1 Haloacetamide compounds, process for production thereof, and use thereof as herbicide TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1986-12-30 EP disclosed
EP-0108570-B1 DISAZO DYESTUFFS FOR CELLULOSE-CONTAINING FIBRES AND PROCESS FOR PREPARING THE DYESTUFF MITSUBISHI KASEI CORPORATION (JP) 1986-10-29 EP disclosed
EP-0121825-B1 MONOAZO DYESTUFFS FOR CELLULOSE-CONTAINING FIBERS MITSUBISHI KASEI CORPORATION (JP) 1986-09-10 EP disclosed
US-4542207-A Heterocyclic monoazo dyes for polyester fibers RESEARCH ASSOCIATION OF SYNTHETIC DYESTUFFS (JP) 1985-09-17 US disclosed
EP-0121825-A1 Monoazo dyestuffs for cellulose-containing fibers MITSUBISHI KASEI CORPORATION (JP) 1984-10-17 EP disclosed
EP-0108570-A2 Disazo dyestuffs for cellulose-containing fibres and process for preparing the dyestuff MITSUBISHI KASEI CORPORATION (JP) 1984-05-16 EP disclosed
US-4313731-A Mono-azo compound, mono-azo dye and dyeing process for polyester fibers MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1982-02-02 US disclosed