SCHEMBL6296237

SCHEMBL6296237

O=C(NC1CCCC1)C(F)(F)F

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.60
PDK2 Q15119 1/20 0.60
PDK3 Q15120 1/20 0.60
PDK4 Q16654 1/20 0.60
EPHX1 P07099 6/20 0.52
SMN1; SMN2 Q16637 5/20 0.52
NPC1 O15118 4/20 0.52
RAB9A P51151 3/20 0.52
MAPT P10636 1/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
CYP3A4 P08684 1/20 0.52
EPHX2 P34913 1/20 0.52
PKM P14618 1/20 0.52
MMP2 P08253 4/20 0.45
CA12 O43570 3/20 0.45
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
CA9 Q16790 3/20 0.45
MMP1 P03956 2/20 0.45

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
SCHEMBL3234006 0.98 PDK1 (0.63) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL12827037 0.95 PDK1 (0.55) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL993860 0.90 PKM (0.61) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL2517789 0.82 EPHX1 (0.55) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL2519751 0.82 EPHX1 (0.55) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL2518911 0.82 EPHX1 (0.55) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL22990996 0.82 PKM (0.53) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL14399467 0.82 PDK1 (0.67) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL3273850 0.82 PKM (0.53) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL29103940 0.82 PDK1 (0.56) PDK1PDK2PDK3PDK4EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240291020-A1 COMPOSITE MATERIAL COMPRISING A FLUORINATED AMIDE AND USES THEREOF IN ELECTROCHEMICAL CELLS HYDRO-QUéBEC (CA) 2024-08-29 US claimed
EP-4356468-A1 COMPOSITE MATERIAL COMPRISING A FLUORINATED AMIDE AND USES THEREOF IN ELECTROCHEMICAL CELLS Hydro-Québec (CA) 2024-04-24 EP claimed
CN-117501498-A Composite materials comprising fluorinated amides and their use in electrochemical cells 魁北克电力公司 2024-02-02 CN claimed
WO-2022261785-A1 COMPOSITE MATERIAL COMPRISING A FLUORINATED AMIDE AND USES THEREOF IN ELECTROCHEMICAL CELLS HYDRO-QUéBEC (CA) 2022-12-22 WO claimed
US-20240291020-A1 COMPOSITE MATERIAL COMPRISING A FLUORINATED AMIDE AND USES THEREOF IN ELECTROCHEMICAL CELLS HYDRO-QUéBEC (CA) 2024-08-29 US disclosed
EP-4356468-A1 COMPOSITE MATERIAL COMPRISING A FLUORINATED AMIDE AND USES THEREOF IN ELECTROCHEMICAL CELLS Hydro-Québec (CA) 2024-04-24 EP disclosed
CN-117501498-A Composite materials comprising fluorinated amides and their use in electrochemical cells 魁北克电力公司 2024-02-02 CN disclosed
EP-4289835-A1 CDK INHIBITOR Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) 2023-12-13 EP disclosed
WO-2022261785-A1 COMPOSITE MATERIAL COMPRISING A FLUORINATED AMIDE AND USES THEREOF IN ELECTROCHEMICAL CELLS HYDRO-QUéBEC (CA) 2022-12-22 WO disclosed
CN-102914606-B Qualitative and quantitative method for various biogenic amines in white wine UNIV JIANGNAN 2014-06-25 CN disclosed
CN-102914606-A Qualitative and quantitative method for various biogenic amines in white wine UNIV JIANGNAN 2013-02-06 CN disclosed
US-6852664-B2 Double metal cyanide catalysts for the preparation of polyether polyols BAYER AKTIENGESELLSCHAFT (DE) 2005-02-08 US disclosed
US-20040092389-A1 Double metal cyanide catalysts for the preparation of polyether polyols BAYER AKTIENGESELLSCHAFT (DE) 2004-05-13 US disclosed
EP-1386662-A1 Double metal cyanide catalysts for preparing polyether polyols Bayer Aktiengesellschaft (DE) 2004-02-04 EP disclosed