SCHEMBL7769282

SCHEMBL7769282

CCN(CCOC(C)OC)c1ccc(N=Nc2cccc(S(=O)(=O)F)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.41
CA2 P00918 5/20 0.41
CA9 Q16790 5/20 0.41
GLO1 Q04760 2/20 0.34
KMT2A Q03164 8/20 0.33
MEN1 O00255 6/20 0.33
MAPT P10636 7/20 0.33
NPC1 O15118 4/20 0.33
RAB9A P51151 4/20 0.33
PSMD14 O00487 2/20 0.33
MITF O75030 1/20 0.33
ALDH1A1 P00352 4/20 0.32
THRB P10828 2/20 0.32
RECQL P46063 2/20 0.32
ATM Q13315 2/20 0.32
RXFP1 Q9HBX9 1/20 0.32
KDM4E B2RXH2 3/20 0.32
GSK3B P49841 2/20 0.32
GAA P10253 1/20 0.32
TDP1 Q9NUW8 3/20 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
SCHEMBL7767878 0.91 MAPT (0.34) CA12CA2CA9KMT2AMEN1
SCHEMBL7764264 0.85 MAPT (0.33) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL7764275 0.84 GSK3B (0.38) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL7764292 0.84 CNR2 (0.32) KMT2AMAPTNPC1RAB9APSMD14
SCHEMBL13029845 0.72 ALDH1A1 (0.44) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL13070309 0.72 TDP1 (0.39) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL597248 0.72 ALDH1A1 (0.39) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL12492278 0.72 ALDH1A1 (0.39) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL11150290 0.71 CA12 (0.53) CA12CA2CA9GLO1KMT2A
SCHEMBL7758370 0.71 CA12 (0.53) CA12CA2CA9GLO1KMT2A

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 3 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 claimed
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