SCHEMBL1112531

SCHEMBL1112531

CS(=O)(=O)c1ccc(-c2ccccc2)c(CN2CCN(c3ccc4c(NS(=O)(=O)c5ccc(N[C@H](CCN6CCOCC6)CSc6ccccc6)c([N+](=O)[O-])c5)ncnc4c3)CC2)c1

nearest known ligand 0.82

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 19/20 0.82
BCL2 P10415 15/20 0.82
BCL2L2 Q92843 4/20 0.70

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
SCHEMBL1112539 1.00 BCL2L1 (0.82) BCL2L1BCL2BCL2L2
SCHEMBL1678299 0.95 BCL2L1 (0.90) BCL2L1BCL2BCL2L2
SCHEMBL1678298 0.95 BCL2L1 (0.90) BCL2L1BCL2BCL2L2
SCHEMBL1677481 0.94 BCL2L1 (0.93) BCL2L1BCL2BCL2L2
SCHEMBL1677478 0.94 BCL2L1 (0.93) BCL2L1BCL2BCL2L2
SCHEMBL1111890 0.94 BCL2L1 (0.82) BCL2L1BCL2BCL2L2
SCHEMBL1111894 0.94 BCL2L1 (0.82) BCL2L1BCL2BCL2L2
SCHEMBL1111860 0.94 BCL2 (0.90) BCL2L1BCL2BCL2L2
SCHEMBL1111857 0.94 BCL2 (0.90) BCL2L1BCL2BCL2L2
SCHEMBL1112265 0.92 BCL2 (0.89) BCL2L1BCL2BCL2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2279174-A2 ARYLSULFONAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF USE Genentech, Inc. (US) 2011-02-02 EP disclosed
WO-2009143246-A2 ARYLSULFONAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF USE GENENTECH, INC. (US) 2009-11-26 WO disclosed