SCHEMBL4664484

SCHEMBL4664484

NS(=O)(=O)c1ccccc1Cc1ccccc1F

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
PTGES2 Q9H7Z7 3/20 0.44
CA1 P00915 8/20 0.44
CA2 P00918 8/20 0.44
CA9 Q16790 5/20 0.44
CA6 P23280 3/20 0.44
CA12 O43570 3/20 0.44
CA4 P22748 2/20 0.44
CA5A P35218 2/20 0.44
CA7 P43166 2/20 0.44
CA5B Q9Y2D0 2/20 0.44
TAAR1 Q96RJ0 1/20 0.44
CYP2C9 P11712 1/20 0.44
CA14 Q9ULX7 1/20 0.44
IDO1 P14902 2/20 0.41
KMT2A Q03164 1/20 0.40

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
SCHEMBL7207427 0.84 CA2 (0.41) LMNAPTGES2CA1CA2CA9
SCHEMBL2397343 0.80 CA2 (0.45) PTGES2CA1CA2CA9CA6
SCHEMBL28815356 0.79 PTGES2 (0.40) LMNAPTGES2CA1CA2CA9
SCHEMBL29258339 0.79 NPC1 (0.44) LMNACA1CA2CA9CA6
SCHEMBL4663042 0.79 KCNA5 (0.43) LMNACA1CA2CA9CA6
SCHEMBL4662992 0.78 PTGES2 (0.54) PTGES2CA1CA2CA9CA6
SCHEMBL4661657 0.78 CA2 (0.44) CA1CA2CA9CA6CA12
SCHEMBL29520231 0.78 CA2 (0.56) PTGES2CA1CA2CA9CA6
SCHEMBL307454 0.78 CA2 (0.56) PTGES2CA1CA2CA9CA6
SCHEMBL407413 0.77 CA2 (0.50) PTGES2CA1CA2CA9CA6

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-2007760-A1 NOVEL SUBSTITUTED-1, 1-DIOXO-BENZO[1,2,4]THIADIZIN-3-ONES, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2008-12-31 EP disclosed
WO-2007108569-A1 NOVEL SUBSTITUTED-1, 1-DIOXO-BENZO[1,2,4]THIADIZIN-3-ONES, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME KOREA RESERACH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2007-09-27 WO disclosed