SCHEMBL5114546

SCHEMBL5114546

Cc1cc(S(=O)(=O)CNCCOCC(=O)N(C)Cc2ccc(C3=NCCN3C(=O)O)cc2)ccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 11/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL5110408 0.90 BDKRB1 (0.40) BDKRB1NPC1RAB9AMEN1KMT2A
SCHEMBL5118645 0.89 BDKRB1 (0.40) BDKRB1MEN1KMT2A
SCHEMBL5118230 0.87 BDKRB1 (0.51) BDKRB1NPC1RAB9A
SCHEMBL5119414 0.87 BDKRB1 (0.51) BDKRB1NPC1RAB9AMEN1KMT2A
SCHEMBL5114552 0.87 LMNA (0.32) NPC1MEN1KMT2AL3MBTL1
SCHEMBL5115133 0.86 BDKRB1 (0.49) BDKRB1MEN1KMT2A
SCHEMBL5114536 0.86 BDKRB1 (0.51) BDKRB1NPC1RAB9AMEN1KMT2A
SCHEMBL5111219 0.86 BDKRB1 (0.45) BDKRB1NPC1RAB9AMEN1KMT2A
SCHEMBL5118018 0.84 BDKRB1 (0.51) BDKRB1MEN1KMT2A
SCHEMBL5114486 0.84 BDKRB1 (0.39) BDKRB1

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-7361687-B2 Arylsulphonamide derivatives and methods of preparing LABORATOIRES FOURNIER SA (FR) 2008-04-22 US disclosed