SCHEMBL7041012

SCHEMBL7041012

CC(C)(CCl)C(O)(Cl)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
SCHEMBL7045301 0.75
SCHEMBL701094 0.74
SCHEMBL2784480 0.73
SCHEMBL31040521 0.72
SCHEMBL15534746 0.72
Hydrochloric Acid SCHEMBL8882610 0.72
SCHEMBL31532320 0.71
SCHEMBL7037732 0.71
SCHEMBL7045302 0.71
SCHEMBL6571605 0.70

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
EP-1034177-B1 PROCESS FOR PRODUCING HALOGEN-CONTAINING PHOSPHATE ESTER DAIHACHI CHEM IND (JP) 2003-03-26 EP disclosed
US-6211396-B1 REACTING A PHOSPHORUS HALIDE SELECTED FROM PHOSPHORUS OXYHALIDES AND PHOSPHORUS PENTAHALIDES WITH A HALOGEN-CONTAINING HYDROXY COMPOUND TO OBTAIN A REACTION MIXTURE INCLUDING A HALOGEN-CONTAINING PHOSPHATE ESTER DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) 2001-04-03 US disclosed
EP-0227528-B1 PROCESS FOR PREPARING HALOGENATED TRIALKYL PHOSPHATE ESTERS THE DOW CHEMICAL COMPANY (US) 1990-03-14 EP disclosed
US-4714771-A Process for preparing halogenated trialkyl phosphate esters THE DOW CHEMICAL COMPANY (US) 1987-12-22 US disclosed
EP-0227528-A1 Process for preparing halogenated trialkyl phosphate esters THE DOW CHEMICAL COMPANY (US) 1987-07-01 EP disclosed
US-4592873-A FLAME RETARDANT FOR POLYMERS BROMINE COMPOUNDS, LTD. (IL) 1986-06-03 US disclosed
US-4046719-A Flame-retardant resinous compositions containing trihaloneopentyl haloalkyl phosphates TENNECO CHEMICALS, INC. (US) 1977-09-06 US disclosed