SCHEMBL7764276

SCHEMBL7764276

O=S(=O)(F)c1ccc(Cl)c(N=Nc2ccc(N(CCO)CCO)cc2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.37
KMT2A Q03164 5/20 0.37
NPC1 O15118 4/20 0.37
RAB9A P51151 4/20 0.37
PSMD14 O00487 1/20 0.37
MITF O75030 1/20 0.37
MEN1 O00255 3/20 0.37
POLB P06746 3/20 0.37
TDP1 Q9NUW8 3/20 0.37
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPK1 P28482 2/20 0.37
MMP14 P50281 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PTGS1 P23219 2/20 0.36
PTGS2 P35354 2/20 0.36
TP53 P04637 1/20 0.36
ATM Q13315 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
VCAM1 P19320 1/20 0.36

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
SCHEMBL7764270 1.00 MAPT (0.37) MAPTKMT2ANPC1RAB9APSMD14
SCHEMBL7769131 0.86 NPC1 (0.41) MAPTKMT2ANPC1RAB9APSMD14
SCHEMBL7769130 0.86 NPC1 (0.41) MAPTKMT2ANPC1RAB9APSMD14
SCHEMBL7768059 0.85 NPC1 (0.44) MAPTKMT2ANPC1RAB9APSMD14
SCHEMBL7768058 0.85 NPC1 (0.44) MAPTKMT2ANPC1RAB9APSMD14
SCHEMBL7768308 0.82 PTGS1 (0.43) MAPTKMT2ANPC1RAB9APSMD14
SCHEMBL7768307 0.82 PTGS1 (0.43) MAPTKMT2ANPC1RAB9APSMD14
SCHEMBL9021055 0.80 PTGS1 (0.50) MAPTKMT2ANPC1RAB9AMEN1
Hydrochloric Acid SCHEMBL9021712 0.79 PTGS1 (0.49) MAPTKMT2ANPC1RAB9AMEN1
SCHEMBL14184216 0.77 NPC1 (0.43) MAPTKMT2ANPC1RAB9APSMD14

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