SCHEMBL8100680

SCHEMBL8100680

O=S(=O)(Nc1cccc(OCBr)c1)c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.55
CA2 P00918 4/20 0.55
LMNA P02545 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
TSHR P16473 1/20 0.49
HTT P42858 1/20 0.49
F2 P00734 5/20 0.46
PKM P14618 2/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.41
GAA P10253 1/20 0.41
CACNA1H O95180 1/20 0.41
CACNA1B Q00975 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
FABP1 P07148 1/20 0.40

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
SCHEMBL5313040 0.87 CA1 (0.56) CA1CA2LMNASMN1; SMN2MEN1
SCHEMBL8364043 0.86 CA1 (0.55) CA1CA2LMNASMN1; SMN2MEN1
SCHEMBL6086574 0.86 SMN1; SMN2 (0.59) CA1CA2LMNASMN1; SMN2MEN1
SCHEMBL8367551 0.86 CA1 (0.55) CA1CA2LMNASMN1; SMN2MEN1
SCHEMBL7113281 0.86 CA1 (0.55) CA1CA2LMNASMN1; SMN2MEN1
SCHEMBL8366086 0.86 CA1 (0.55) CA1CA2LMNASMN1; SMN2MEN1
SCHEMBL8365986 0.85 CA1 (0.53) CA1CA2LMNASMN1; SMN2MEN1
SCHEMBL6087495 0.81 SMN1; SMN2 (0.68) CA1CA2LMNASMN1; SMN2MEN1
SCHEMBL6087557 0.80 CA1 (0.57) CA1CA2LMNASMN1; SMN2MEN1
SCHEMBL31034706 0.80 CA1 (0.57) CA1CA2LMNASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0896533-A4 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK INC (US) 1999-04-28 EP claimed
EP-0896533-A2 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1999-02-17 EP claimed
WO-1997030677-A2 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1997-08-28 WO claimed
EP-0939627-A4 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK INC (US) 2000-10-04 EP disclosed
EP-0939627-A1 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1999-09-08 EP disclosed
EP-0896533-A4 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK INC (US) 1999-04-28 EP disclosed
EP-0896533-A2 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1999-02-17 EP disclosed
WO-1998005315-A1 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1998-02-12 WO disclosed
WO-1997030677-A2 PENTAFLUOROBENZENESULFONAMIDES AND ANALOGS TULARIK, INC. (US) 1997-08-28 WO disclosed