SCHEMBL7768072

SCHEMBL7768072

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 6/20 0.41
AMY1A P0DUB6 4/20 0.39
CA12 O43570 4/20 0.38
CA2 P00918 4/20 0.38
CA9 Q16790 4/20 0.38
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
SLC2A1 P11166 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CA1 P00915 1/20 0.36
CA3 P07451 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
PKM P14618 1/20 0.35
KMT2A Q03164 1/20 0.35
RPS6KA3 P51812 1/20 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
SCHEMBL7768073 1.00 BRD4 (0.41) BRD4AMY1ACA12CA2CA9
SCHEMBL7768058 0.81 NPC1 (0.44) BRD4AMY1ACA12CA2CA9
SCHEMBL7768059 0.81 NPC1 (0.44) BRD4AMY1ACA12CA2CA9
SCHEMBL7769138 0.76 MAPT (0.40) CA12CA2CA9LMNAMAPT
SCHEMBL7769136 0.76 MAPT (0.40) CA12CA2CA9LMNAMAPT
SCHEMBL19648759 0.73 BRD4 (0.46) BRD4LMNAMAPTHTTALDH1A1
SCHEMBL18409050 0.72 MAPT (0.57) LMNAMAPTHTTALDH1A1KMT2A
SCHEMBL19648780 0.72 BRD4 (0.44) BRD4LMNAMAPTALDH1A1KMT2A
SCHEMBL7767895 0.72 MAPT (0.57) LMNAMAPTHTTALDH1A1PKM
SCHEMBL7767891 0.72 MAPT (0.57) LMNAMAPTHTTALDH1A1PKM

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