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Sugi Predict / Compounds / SCHEMBL296313

SCHEMBL296313

SCHEMBL296313

CC(C)(C)OC(=O)NC1(C(=O)O)CC(OS(=O)(=O)C(F)(F)F)C1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ RORC P51449 3/20 0.32
▸ BTK Q06187 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
SCHEMBL14640259 0.90 MEN1 (0.34) MEN1MAPK1KMT2ARORC
SCHEMBL2671553 0.90 MEN1 (0.34) MEN1MAPK1KMT2ARORC
SCHEMBL23833798 0.86 MEN1 (0.33) MEN1MAPK1KMT2ARORC
SCHEMBL23833800 0.86 MEN1 (0.33) MEN1MAPK1KMT2ARORC
SCHEMBL23833802 0.86 MEN1 (0.33) MEN1MAPK1KMT2ARORC
SCHEMBL23833789 0.86 MEN1 (0.33) MEN1MAPK1KMT2ARORC
SCHEMBL6012170 0.85 MEN1 (0.32) MEN1MAPK1KMT2A
SCHEMBL296096 0.85 MEN1 (0.32) MEN1MAPK1KMT2A
SCHEMBL3179619 0.85 MEN1 (0.32) MEN1MAPK1KMT2A
SCHEMBL3171797 0.82 MEN1 (0.34) MEN1MAPK1KMT2ARORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2017258-B1 PROCESS FOR PRODUCTION OF RADIOACTIVE FLUORINE-LABELED ORGANIC COMPOUND NIHON MEDIPHYSICS CO LTD (JP) 2012-03-14 — — EP disclosed
EP-2017258-A1 PROCESS FOR PRODUCTION OF RADIOACTIVE FLUORINE-LABELED ORGANIC COMPOUND NIHON MEDI-PHYSICS CO., LTD. (JP) 2009-01-21 — — EP disclosed