SCHEMBL8113406

SCHEMBL8113406

O=[N+]([O-])c1c(OS(=O)(=O)C(F)(F)F)nc2c(c1OS(=O)(=O)C(F)(F)F)CCCC2

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ACHE P22303 5/20 0.33
APP P05067 1/20 0.31
BCHE P06276 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
SCHEMBL6952130 0.99 SMN1; SMN2 (0.36) SMN1; SMN2L3MBTL1ACHEAPPBCHE
SCHEMBL6953068 0.85 ACHE (0.33) SMN1; SMN2L3MBTL1ACHE
SCHEMBL6947707 0.80 KDM4E (0.42) SMN1; SMN2L3MBTL1ACHEBCHE
SCHEMBL8122765 0.78 ACHE (0.34) SMN1; SMN2L3MBTL1ACHEBCHE
SCHEMBL8128249 0.78 ACHE (0.37) ACHEBCHE
SCHEMBL8122861 0.78 ACHE (0.36) ACHEBCHE
SCHEMBL8127299 0.78 MEN1 (0.35) SMN1; SMN2L3MBTL1ACHEBCHE
SCHEMBL6954348 0.77 BCHE (0.40) ACHEBCHE
SCHEMBL8121921 0.76 ALDH1A1 (0.34) L3MBTL1ACHEBCHE
SCHEMBL8121141 0.74 ALDH1A1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708773-B1 FUSED CYCLOALKYLIMIDAZOPYRIDINES MINNESOTA MINING & MFG (US) 2000-10-04 EP disclosed
US-5648516-A INTERFERON BIOSYNTHESIS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-07-15 US disclosed
US-5627281-A CHEMCAL INTERMEDIATES FOR VIRICIDES BY INDUCING SYNTHESIS OF INTERFERONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-05-06 US disclosed
EP-0708773-A1 FUSED CYCLOALKYLIMIDAZOPYRIDINES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-05-01 EP disclosed
US-5444065-A Viricides MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-08-22 US disclosed
WO-1995002598-A1 FUSED CYCLOALKYLIMIDAZOPYRIDINES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-01-26 WO disclosed
US-5352784-A Viricides; immunomodulators MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-10-04 US disclosed