SCHEMBL1704692

SCHEMBL1704692

CN1C(=O)[C@H](Cc2cc(CO)ccc2F)N(OC(=O)OC(C)(C)C)[C@H]1C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
CAPN1 P07384 1/20 0.30

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
SCHEMBL2307277 1.00 CYP4F2 (0.33) CYP4F2CYP4A11CAPN1
SCHEMBL1754802 0.84 CYP4F2 (0.34) CYP4F2CYP4A11CAPN1
SCHEMBL3101678 0.84 CYP4F2 (0.34) CYP4F2CYP4A11CAPN1
SCHEMBL3100440 0.84 CYP4F2 (0.34) CYP4F2CYP4A11CAPN1
SCHEMBL2306269 0.83 HTR2C (0.34)
SCHEMBL3094517 0.70 GPR119 (0.32)
SCHEMBL1754821 0.69 HTR2C (0.35)
SCHEMBL30492183 0.66 USP30 (0.40)
SCHEMBL12589246 0.64 DPP4 (0.31)
SCHEMBL12437861 0.63 MRGPRX4 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2357178-B1 Process for the production of L-2-[18F]fluor-phenylalanine and 6-[18F]fluor-L-meta-tyrosine and their alpha-alkylated derivatives from a precursor. FORSCHUNGSZENTRUM JUELICH GMBH (DE) 2014-05-07 EP disclosed
EP-2222644-B9 METHOD FOR PRODUCING PRECURSORS FOR L-2-[18F]FLUOROPHENYLALANINE AND 6-[18F]FLUORO-L--META-TYROSINE AND THE ALPHA -METHYLATED DERIVATIVES THEREOF AND THE PRECURSORS FORSCHUNGSZENTRUM JUELICH GMBH (DE) 2012-04-18 EP disclosed
EP-2357178-A1 Process for the production of L-2-[18F]fluor-phenylalanine and 6-[18F]fluor-L-meta-tyrosine and their alpha-alkylated derivatives from a precursor Forschungszentrum Jülich GmbH (DE) 2011-08-17 EP disclosed
EP-2222644-A2 METHOD FOR PRODUCING PRECURSORS FOR L-2-[18F]FLUOROPHENYLALANINE AND 6-[18F]FLUORO-L--META-TYROSINE AND THE ALPHA -METHYLATED DERIVATIVES THEREOF, PRECURSOR, AND METHOD FOR PRODUCING L-2-[18F]FLUOROPHENYLALANINE AND 6-[18F]FLUORO-L-META-TYROSINE AND THE ALPHA-METHYLATED DERIVATIVES FROM THE PRECURSOR Forschungszentrum Jülich GmbH (DE) 2010-09-01 EP disclosed
WO-2009071050-A2 METHOD FOR PRODUCING PRECURSORS FOR L-2-[18F]FLUOROPHENYLALANINE AND 6-[18F]FLUORO-L--META-TYROSINE AND THE α-METHYLATED DERIVATIVES THEREOF, PRECURSOR, AND METHOD FOR PRODUCING L-2-[18F]FLUOROPHENYLALANINE AND 6-[18F]FLUORO-L-META-TYROSINE AND THE α-METHYLATED DERIVATIVES FROM THE PRECURSOR Forschungszentrum Jülich GmbH (DE) 2009-06-11 WO disclosed