SCHEMBL8727724

SCHEMBL8727724

N=Nc1cccc(S(=O)(=O)F)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.40
CA2 P00918 12/20 0.39
CA9 Q16790 9/20 0.39
CA1 P00915 5/20 0.39
CA7 P43166 4/20 0.39
CA12 O43570 4/20 0.39
GLO1 Q04760 4/20 0.38
POLB P06746 1/20 0.36
APOBEC3G Q9HC16 1/20 0.33
LMNA P02545 1/20 0.32
SUMO2 P61956 1/20 0.32
SUMO1 P63165 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP3 Q9H4L4 1/20 0.32
SENP2 Q9HC62 1/20 0.32
SENP1 Q9P0U3 1/20 0.32
CA4 P22748 1/20 0.32

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
SCHEMBL8727720 0.80 CA2 (0.41) NOS1CA2CA9CA1CA7
SCHEMBL2631143 0.80 TDP1 (0.52) NOS1CA2CA9CA1CA7
SCHEMBL10571503 0.78 CA2 (0.55) CA2CA9CA1CA7CA12
SCHEMBL6313736 0.77 CA2 (0.40) NOS1CA2CA9CA1CA7
SCHEMBL8724038 0.74 F2 (0.42) NOS1CA2CA9CA1CA7
SCHEMBL19122491 0.72 CA2 (0.45) CA2CA9CA1CA12APOBEC3G
SCHEMBL8014338 0.72 CA2 (0.48) CA2CA9CA1CA12APOBEC3G
SCHEMBL1889098 0.70 CA12 (0.47) CA2CA9CA1CA12
SCHEMBL1018322 0.68 PGR (0.52) LMNA
SCHEMBL4619061 0.68 KMT2A (0.55)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5739299-A GOOD WET FASTNESS AND LIGHT FASTNESS PROPERTIES ZENECA LIMITED (GB) 1998-04-14 US claimed