SCHEMBL17793726

SCHEMBL17793726

O=[N+]([O-])c1ccccc1S(=O)(=O)NCC(F)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.55
▸ CYP19A1 P11511 1/20 0.54
▸ KMT2A Q03164 4/20 0.54
▸ MEN1 O00255 3/20 0.54
▸ CA1 P00915 1/20 0.52
▸ CA2 P00918 1/20 0.52
▸ MMP1 P03956 1/20 0.52
▸ MMP2 P08253 1/20 0.52
▸ MMP9 P14780 1/20 0.52
▸ MMP8 P22894 1/20 0.52
▸ MMP13 P45452 1/20 0.52
▸ ALDH1A1 P00352 3/20 0.52
▸ AR P10275 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ HTT P42858 1/20 0.46
▸ CA12 O43570 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ F2 P00734 1/20 0.46
▸ PRSS1 P07477 1/20 0.46

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
SCHEMBL17793727 0.90 LMNA (0.51) LMNACYP19A1KMT2AMEN1CA1
SCHEMBL17793725 0.90 ALDH1A1 (0.54) LMNACYP19A1KMT2AMEN1CA1
SCHEMBL17793730 0.88 ALDH1A1 (0.49) LMNACYP19A1KMT2AMEN1CA1
SCHEMBL6925091 0.84 CA1 (0.56) LMNACYP19A1KMT2AMEN1CA1
SCHEMBL28897943 0.82 CA1 (0.54) LMNACYP19A1KMT2AMEN1CA1
SCHEMBL28897944 0.82 CA1 (0.54) LMNACYP19A1KMT2AMEN1CA1
SCHEMBL1548112 0.80 ALDH1A1 (0.60) LMNACYP19A1KMT2AMEN1CA1
SCHEMBL25353698 0.80 CA1 (0.51) LMNACYP19A1KMT2AMEN1CA1
SCHEMBL17793719 0.80 KMT2A (0.58) LMNACYP19A1KMT2AMEN1CA1
SCHEMBL25353051 0.78 CA1 (0.52) LMNACYP19A1KMT2AMEN1CA1

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
WO-2016082052-A1 COMPOUNDS DERIVED FROM 2-PHENYL-2-FLUOROSULFONAMIDES, USED AS BUILDING BLOCKS IN ORGANIC SYNTHESIS, AND METHOD FOR THE PRODUCTION THEREOF PONTIFICIA UNIVERSIDAD CATOLICA DE CHILE (CL) 2016-06-02 — — WO disclosed
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