SCHEMBL4639010

SCHEMBL4639010

NS(=O)(=O)c1ccccc1CC1=CCOC=C1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.35
CA1 P00915 7/20 0.35
CA9 Q16790 4/20 0.35
CA6 P23280 3/20 0.35
CA4 P22748 2/20 0.35
CA12 O43570 2/20 0.35
CA5A P35218 2/20 0.35
CA7 P43166 2/20 0.35
CA5B Q9Y2D0 2/20 0.35
CYP2C9 P11712 1/20 0.35
CA14 Q9ULX7 1/20 0.35
PTGES2 Q9H7Z7 1/20 0.32
CTSB P07858 1/20 0.31
PLCG1 P19174 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
SCHEMBL30755329 0.72 CA2 (0.38) CA2CA1CA9CA6CA4
SCHEMBL4616951 0.72 CA2 (0.38) CA2CA1CA9CA6CA4
SCHEMBL30988956 0.68 CA2 (0.50) CA2CA1CA9CA6CA4
SCHEMBL407413 0.68 CA2 (0.50) CA2CA1CA9CA6CA4
SCHEMBL8349565 0.66 CA2 (0.54) CA2CA1CA9CA6CA4
Hydrochloric Acid SCHEMBL3517386 0.66 CA1 (0.49) CA2CA1CA9CA6CA4
Methane SCHEMBL28850761 0.66 CA2 (0.49) CA2CA1CA9CA6CA4
SCHEMBL4662992 0.65 PTGES2 (0.54) CA2CA1CA9CA6CA4
SCHEMBL4661657 0.65 CA2 (0.44) CA2CA1CA9CA6CA4
SCHEMBL4664484 0.65 LMNA (0.46) CA2CA1CA9CA6CA4

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-1879859-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF Wyeth a Corporation of the State of Delaware (US) 2008-01-23 EP claimed
WO-2006124875-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF WYETH (US) 2006-11-23 WO claimed