SCHEMBL4801783

SCHEMBL4801783

NS(=O)(=O)c1ccc2cc(S(=O)(=O)N(c3ccccc3)c3ccccc3)ccc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.62
PKM P14618 1/20 0.56
ESR1 P03372 1/20 0.53
CA2 P00918 9/20 0.51
CA1 P00915 7/20 0.51
CA9 Q16790 6/20 0.51
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 2/20 0.45
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CA12 O43570 4/20 0.44
CA7 P43166 3/20 0.44
CA4 P22748 2/20 0.44
CA5A P35218 2/20 0.44
CA5B Q9Y2D0 2/20 0.44
CA3 P07451 1/20 0.44
CA6 P23280 1/20 0.44
PLA2G7 Q13093 1/20 0.44
CA13 Q8N1Q1 1/20 0.44

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
SCHEMBL8976129 0.84 PKM (0.71) PKMESR1CA2CA1CA9
SCHEMBL193716 0.78 LMNA (1.00) LMNACA2CA1CA9MEN1
SCHEMBL9839080 0.78 LMNA (0.82) LMNAPKMCA2CA1CA9
SCHEMBL28228467 0.76 LMNA (0.96) LMNACA2CA1CA9MEN1
SCHEMBL3154840 0.76 LMNA (0.88) LMNACA2CA1CA9MEN1
SCHEMBL4506268 0.75 CA1 (0.44) LMNAPKMESR1CA2CA1
SCHEMBL4799669 0.74 ALDH1A1 (0.69) LMNAPKMESR1MEN1KMT2A
SCHEMBL812682 0.73 PKM (0.79) LMNAPKMESR1CA2CA1
SCHEMBL4494785 0.73 ESR1 (0.49) LMNAPKMESR1CA2CA1
Methanesulfonamide SCHEMBL11803937 0.73 LMNA (0.88) LMNACA2CA1CA9MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060128978-A1 Diepoxide derivatives of N, N*-disubstituted disulfonamides PEWS R G 2006-06-15 US claimed
US-20080312404-A1 Novel diepoxides and epoxy resins PEWS R GARTH 2008-12-18 US disclosed
US-7462728-B2 Diepoxide derivatives of N,N*-disubstituted disulfonamides PEWS R GARTH 2008-12-09 US disclosed
US-20060128978-A1 Diepoxide derivatives of N, N*-disubstituted disulfonamides PEWS R G 2006-06-15 US disclosed