SCHEMBL5152479

SCHEMBL5152479

CC(C)(F)C1CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.34
PDK2 Q15119 1/20 0.34
PDK3 Q15120 1/20 0.34
PDK4 Q16654 1/20 0.34
EPHX1 P07099 1/20 0.31
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CYP1A2 P05177 1/20 0.31
SSTR4 P31391 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL22371828 1.00 PDK1 (0.34) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL22694798 1.00 PDK1 (0.34) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL28984601 0.97
SCHEMBL1545093 0.83
SCHEMBL17885864 0.81 PDK1 (0.34) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL1034374 0.81 PDK1 (0.34) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL20434835 0.79 PDK1 (0.33) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL17885866 0.78 PDK1 (0.31) PDK1PDK2PDK3PDK4
SCHEMBL6114283 0.78
SCHEMBL8518512 0.77 PDK1 (0.36) PDK1PDK2PDK3PDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993018748-A1 COMPOSITIONS COMPRISING A DRUG DELIVERY VEHICLE SUSPENDED IN A NONAQUEOUS FLUORINATED LIQUID ALLERGAN, INC. (US) 1993-09-30 WO claimed
CN-118956350-A Refrigerant compositions comprising HFC-32, CF3I and CO2 科慕埃弗西有限公司 2024-11-15 CN disclosed
CN-114364767-B Refrigerant compositions comprising HFC-32, CF31 and CO2 科慕埃弗西有限公司 2024-08-13 CN disclosed
CN-113518815-B Heat transfer compositions comprising R-1225ye (E) 科慕埃弗西有限公司 2024-04-26 CN disclosed
US-7235227-B2 Paramagnetic particles that provide improved relaxivity BARNES-JEWISH HOSPITAL (US) 2007-06-26 US disclosed
EP-1487334-A4 PARAMAGNETIC PARTICLES THAT PROVIDE IMPROVED RELAXIVITY BARNES JEWISH HOSPITAL (US) 2006-10-25 EP disclosed
WO-2006083269-A2 LUMINESCENT NANOSENSORS FLORIDA ATLANTIC UNIVERSITY (US) 2006-08-10 WO disclosed
WO-2005097208-A2 TISSUE OXYGENATION MEASUREMENTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2005-10-20 WO disclosed
US-6869591-B2 Paramagnetic particles that provide improved relaxivity BARNES-JEWISH HOSPITAL (US) 2005-03-22 US disclosed
EP-1487334-A1 PARAMAGNETIC PARTICLES THAT PROVIDE IMPROVED RELAXIVITY Barnes-Jewish Hospital (US) 2004-12-22 EP disclosed
WO-2003082105-A1 PARAMAGNETIC PARTICLES THAT PROVIDE IMPROVED RELAXIVITY BARNES-JEWISH HOSPITAL (US) 2003-10-09 WO disclosed
US-20030185760-A1 Paramagnetic particles that provide improved relaxivity KEREOS, INC. 2003-10-02 US disclosed
EP-0794801-A1 PARAMAGNETIC COMPLEXES OF N-ALKYL-N-HYDROXYLAMIDES OF ORGANIC ACIDS AND EMULSIONS CONTAINING SAME FOR MAGNETIC RESONANCE IMAGING (MRI) HEMAGEN/PFC (US) 1997-09-17 EP disclosed
US-5614170-A CONTRAST AGENTS OF DIETHYLENETRIAMINEPENTAACETIC ACID CHELATE COMPOUNDS HEMAGEN/PFC (US) 1997-03-25 US disclosed
US-5571498-A Emulsions of paramagnetic contrast agents for magnetic resonance imaging (MRI). HEMAGEN/PFC (US) 1996-11-05 US disclosed
WO-1996016679-A1 PARAMAGNETIC COMPLEXES OF N-ALKYL-N-HYDROXYLAMIDES OF ORGANIC ACIDS AND EMULSIONS CONTAINING SAME FOR MAGNETIC RESONANCE IMAGING (MRI) HEMAGEN/PFC (US) 1996-06-06 WO disclosed
WO-1995033494-A1 EMULSIONS OF PARAMAGNETIC CONTRAST AGENTS FOR MAGNETIC RESONANCE IMAGING (MRI), CONTAINING AN ORGANIC CHELATOR HAVING AN UNSATURATED ALIPHATIC GROUP HEMAGEN/PFC (US) 1995-12-14 WO disclosed
WO-1993018748-A1 COMPOSITIONS COMPRISING A DRUG DELIVERY VEHICLE SUSPENDED IN A NONAQUEOUS FLUORINATED LIQUID ALLERGAN, INC. (US) 1993-09-30 WO disclosed
WO-1992021688-A1 NEW PERFLUOROALKYLATED AMPHIPHILIC PHOSPHORUS COMPOUNDS: PREPARATION AND BIOMEDICAL APPLICATIONS S.A. A.T.T.A. APPLICATIONS ET TRANSFERTS DE TECHN OLOGIES AVANCEES (FR) 1992-12-10 WO disclosed
EP-0089815-A1 Liquid perfluorocarbons, for use in ocular therapy, and preparations containing them Haidt, Sterling Joel (US) 1983-09-28 EP disclosed