SCHEMBL3373630

SCHEMBL3373630

[2H]C([2H])([O])F

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
SCHEMBL14993133 0.78
SCHEMBL21079 0.75
SCHEMBL9352 0.72
SCHEMBL13937029 0.62
SCHEMBL18806904 0.62
SCHEMBL14788374 0.62
SCHEMBL12639908 0.62
SCHEMBL8682 0.62
SCHEMBL23849487 0.59
SCHEMBL19292 0.58

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
WO-2024151346-A1 HETEROARYL FLUOROALKENES AS DGK INHIBITORS INCYTE CORPORATION (US) 2024-07-18 WO disclosed
US-20240217989-A1 Heteroaryl Fluoroalkenes As DGK Inhibitors INCYTE CORPORATION 2024-07-04 US disclosed
WO-2024108100-A1 HETEROARYL FLUOROALKENES AS DGK INHIBITORS INCYTE CORPORATION (US) 2024-05-23 WO disclosed
EP-2785381-B1 FLUORINE-18 AND CARBON-11 LABELED RADIOLIGANDS FOR POSITRON EMISSION TOMOGRAPHY (PET) IMAGING FOR LRRK2 HOFFMANN LA ROCHE (CH) 2016-05-18 EP disclosed
US-9139566-B2 Fluorine-18 and carbon-11 labeled radioligands for positron emission tomography (PET) imaging for LRRK2 GENENTECH, INC. (US) 2015-09-22 US disclosed
EP-2785381-A1 FLUORINE-18 AND CARBON-11 LABELED RADIOLIGANDS FOR POSITRON EMISSION TOMOGRAPHY (PET) IMAGING FOR LRRK2 F.HOFFMANN-LA ROCHE AG (CH) 2014-10-08 EP disclosed
US-20130156700-A1 FLUORINE-18 AND CARBON-11 LABELED RADIOLIGANDS FOR POSITRON EMISSION TOMOGRAPHY (PET) IMAGING FOR LRRK2 GENENTECH, INC. (US) 2013-06-20 US disclosed
WO-2013079496-A1 FLUORINE-18 AND CARBON-11 LABELED RADIOLIGANDS FOR POSITRON EMISSION TOMOGRAPHY (PET) IMAGING FOR LRRK2 F. HOFFMANN-LA ROCHE AG (CH) 2013-06-06 WO disclosed
EP-1545525-B1 RADIOLABELED NEUROKININ-1 RECEPTOR ANTAGONISTS MERCK SHARP & DOHME (US) 2010-11-10 EP disclosed
EP-1545525-A4 RADIOLABELED NEUROKININ-1 RECEPTOR ANTAGONISTS MERCK & CO INC (US) 2009-07-01 EP disclosed
US-7354935-B2 Radiolabeled neurokinin-1 receptor antagonists MERCK & CO. INC. (US) 2008-04-08 US disclosed
US-20050214204-A1 Radiolabeled neurokinin-1 receptor antagonists MERCK SHARP & DOHME CORP. 2005-09-29 US disclosed
EP-1545525-A2 RADIOLABELED NEUROKININ-1 RECEPTOR ANTAGONISTS Merck & Co., Inc. (US) 2005-06-29 EP disclosed
WO-2004029024-A2 RADIOLABELED NEUROKININ-1 RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2004-04-08 WO disclosed