SCHEMBL7768058

SCHEMBL7768058

Cc1ccc(S(=O)(=O)F)cc1/N=N/c1ccc(N(CCO)CCO)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.44
RAB9A P51151 5/20 0.44
MAPT P10636 5/20 0.44
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
TDP1 Q9NUW8 3/20 0.44
POLB P06746 2/20 0.44
LMNA P02545 2/20 0.44
MAPK1 P28482 2/20 0.44
MMP14 P50281 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PSMD14 O00487 1/20 0.42
MITF O75030 1/20 0.42
CA2 P00918 3/20 0.36
CA12 O43570 2/20 0.36
CA9 Q16790 2/20 0.36
F2 P00734 3/20 0.35
PRSS1 P07477 3/20 0.35
PRSS2 P07478 3/20 0.35

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
SCHEMBL7768059 1.00 NPC1 (0.44) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL7767891 0.89 MAPT (0.57) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL7767895 0.89 MAPT (0.57) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL7769138 0.86 MAPT (0.40) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL7769136 0.86 MAPT (0.40) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL7769131 0.86 NPC1 (0.41) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL7769130 0.86 NPC1 (0.41) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL7764276 0.85 MAPT (0.37) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL7764270 0.85 MAPT (0.37) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL7768308 0.85 PTGS1 (0.43) NPC1RAB9AMAPTKMT2AMEN1

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