SCHEMBL7764285

SCHEMBL7764285

COc1cc(S(=O)(=O)F)c(OC)cc1N

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.70
L3MBTL1 Q9Y468 2/20 0.44
POLB P06746 1/20 0.44
GAA P10253 1/20 0.42
S100B P04271 1/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
MMP13 P45452 1/20 0.40
HTR2A P28223 4/20 0.40
HTR2C P28335 3/20 0.40
HTR2B P41595 3/20 0.40
ALDH1A1 P00352 5/20 0.39
CYP3A4 P08684 3/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL8777777 0.82 PKM (1.00) PKML3MBTL1POLBGAAS100B
SCHEMBL30068292 0.82 PKM (1.00) PKML3MBTL1POLBGAAS100B
SCHEMBL4650366 0.81 PKM (0.70) PKML3MBTL1POLBGAAS100B
SCHEMBL8498272 0.81 PKM (0.70) PKML3MBTL1POLBGAAS100B
SCHEMBL5710482 0.78 PKM (0.66) PKML3MBTL1POLBGAAS100B
SCHEMBL4610100 0.78 PKM (0.66) PKML3MBTL1POLBGAAS100B
SCHEMBL6416759 0.77 PKM (0.64) PKML3MBTL1POLBGAAS100B
SCHEMBL4380113 0.77 PKM (0.64) PKML3MBTL1POLBGAAS100B
SCHEMBL926329 0.76 L3MBTL1 (0.67) PKML3MBTL1POLBGAAS100B
SCHEMBL31618987 0.76 ALDH1A1 (0.47) PKML3MBTL1GAAHTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0740690-B1 MONOAZO DYES CONTAINING A FLUOROSULPHONYL GROUP AND USE THEREOF SYNGENTA LTD (GB) 2001-06-20 EP disclosed
US-5739299-A GOOD WET FASTNESS AND LIGHT FASTNESS PROPERTIES ZENECA LIMITED (GB) 1998-04-14 US disclosed
EP-0740690-A1 MONOAZO DYES CONTAINING A FLUOROSULPHONYL GROUP AND USE THEREOF ZENECA LIMITED (GB) 1996-11-06 EP disclosed
WO-1995020014-A1 MONOAZO DYES CONTAINING A FLUOROSULPHONYL GROUP AND USE THEREOF ZENECA LIMITED (GB) 1995-07-27 WO disclosed