SCHEMBL952555

SCHEMBL952555

C#Cc1c(F)c(F)c(F)c(F)c1F

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
SCHEMBL5476187 0.96
SCHEMBL9775435 0.96
SCHEMBL7687536 0.92
SCHEMBL10423203 0.86
SCHEMBL10584204 0.81
SCHEMBL16627103 0.81
SCHEMBL17768962 0.81
SCHEMBL18531350 0.81
SCHEMBL10424795 0.76
SCHEMBL10582414 0.74 POLB (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 118 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997010193-A9 ETHYNYL SUBSTITUTED AROMATIC COMPOUNDS, SYNTHESIS, POLYMERS AND USES THEREOF THE DOW CHEMICAL COMPANY (US) 2018-02-08 WO claimed
US-8519080-B2 Crosslinkable prepolymer, its production process and its uses ASAHI GLASS COMPANY, LIMITED (JP) 2013-08-27 US claimed
JP-4260882-B2 2009-04-30 JP claimed
EP-1599487-B1 PHOSPHINIC ACID ANALOGS OF GLUTAMATE GIVAUDAN SA (CH) 2007-07-11 EP claimed
EP-0854849-B1 ETHYNYL SUBSTITUTED AROMATIC COMPOUNDS, SYNTHESIS, POLYMERS AND USES THEREOF DOW CHEMICAL CO (US) 2001-10-31 EP claimed
EP-0854849-A1 ETHYNYL SUBSTITUTED AROMATIC COMPOUNDS, SYNTHESIS, POLYMERS AND USES THEREOF THE DOW CHEMICAL COMPANY (US) 1998-07-29 EP claimed
WO-1997010193-A1 ETHYNYL SUBSTITUTED AROMATIC COMPOUNDS, SYNTHESIS, POLYMERS AND USES THEREOF THE DOW CHEMICAL COMPANY (US) 1997-03-20 WO claimed
EP-0337820-B1 PENTAFLUOROPHENYL DERIVATIVES, METHODS OF PRODUCTION OF SUCH DERIVATIVES INCLUDING OPTICALLY ACTIVE DERIVATIVES, AND METHOD OF OPTICAL RESOLUTION OF CHIRAL CARBOXYLIC ACIDS NIKKO KYODO CO., LTD. (JP) 1993-07-28 EP claimed
US-20240096631-A1 HALOALKYNYL DICOBALT HEXACARBONYL PRECURSORS FOR CHEMICAL VAPOR DEPOSITION OF COBALT ENTEGRIS, INC. 2024-03-21 US disclosed
US-11919921-B2 Galactoside inhibitor of galectins GALECTO BIOTECH AB (DK) 2024-03-05 US disclosed
US-11804375-B2 Haloalkynyl dicobalt hexacarbonyl precursors for chemical vapor deposition of cobalt ENTEGRIS, INC. (US) 2023-10-31 US disclosed
US-20220289783-A1 NOVEL GALACTOSIDE INHIBITOR OF GALECTINS GALECTO BIOTECH AB (DK) 2022-09-15 US disclosed
US-11377464-B2 Galactoside inhibitor of galectins GALECTO BIOTECH AB (DK) 2022-07-05 US disclosed
CN-109996803-B Haloalkynyl hexacarbonylcobaltic precursors for chemical vapor deposition of cobalt 恩特格里斯公司 2022-01-11 CN disclosed
EP-0623140-A1 NOVEL 19-NOR STEROIDS HAVING A THIOCARBON-CONTAINING CHAIN IN THE 11BETA POSITION, A METHOD FOR PREPARING SAME AND INTERMEDIATES THEREFOR, MEDICINAL USES THEREOF AND COMPOSITIONS CONTAINING SAID STEROIDS ROUSSEL UCLAF (FR) 1994-11-09 EP disclosed
WO-1993013123-A1 NOVEL 19-NOR STEROIDS HAVING A THIOCARBON-CONTAINING CHAIN IN THE 11BETA POSITION, A METHOD FOR PREPARING SAME AND INTERMEDIATES THEREFOR, MEDICINAL USES THEREOF AND COMPOSITIONS CONTAINING SAID STEROIDS ROUSSEL-UCLAF (FR) 1993-07-08 WO disclosed
US-4987209-A Diethynyl monomers and polymers thereof THE PRESIDENT AND FELLOWS OF HARVARD (US) 1991-01-22 US disclosed
EP-0235049-B1 TIN-BASED CATALYST MIXTURE FOR ROOM TEMPERATURE VULCANISABLE POLYSILOXANE COMPOSITIONS RHONE-POULENC CHIMIE (FR) 1990-07-11 EP disclosed
US-4892975-A Diethynyl monomers and polymers thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1990-01-09 US disclosed
EP-0235049-A1 Tin-based catalyst mixture for room temperature vulcanisable polysiloxane compositions RHONE-POULENC CHIMIE (FR) 1987-09-02 EP disclosed