SCHEMBL9696039

SCHEMBL9696039

COC(=O)C(C)(F)[C@@H]1COC(C)(C)O1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 4/20 0.33
HCRTR1 O43613 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
CA2 P00918 2/20 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
SCHEMBL9696043 1.00 HCRTR2 (0.33) HCRTR2HCRTR1L3MBTL1CA2
SCHEMBL9695845 1.00 HCRTR2 (0.33) HCRTR2HCRTR1L3MBTL1CA2
SCHEMBL9696056 0.85 L3MBTL1 (0.35) HCRTR2HCRTR1L3MBTL1CA2
SCHEMBL9694546 0.85 L3MBTL1 (0.35) HCRTR2HCRTR1L3MBTL1CA2
SCHEMBL9695839 0.76 CA2 (0.33) CA2
SCHEMBL9696049 0.76 CA2 (0.33) CA2
SCHEMBL14793073 0.74 MMP9 (0.32) HCRTR2HCRTR1
SCHEMBL14790181 0.74 MMP9 (0.32) HCRTR2HCRTR1
SCHEMBL14790179 0.74 MMP9 (0.32) HCRTR2HCRTR1
SCHEMBL28595773 0.73 CA2 (0.32) CA2

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-0463470-A2 Process for the preparation of a fluorotetrahydrofuranone derivative F. HOFFMANN-LA ROCHE AG (CH) 1992-01-02 EP claimed
EP-0463470-A2 Process for the preparation of a fluorotetrahydrofuranone derivative F. HOFFMANN-LA ROCHE AG (CH) 1992-01-02 EP disclosed