SCHEMBL5114552

SCHEMBL5114552

Cc1cc(S(=O)(=O)CNCCOCC(=O)CNCc2ccc(C3=NCCN3C(=O)O)cc2)ccc1Cl

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
KDM4E B2RXH2 2/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PTGS2 P35354 1/20 0.30

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
SCHEMBL5110428 0.90 LMNA (0.40) LMNATDP1MEN1KMT2A
SCHEMBL5118651 0.88 HSD11B1 (0.34) LMNAKMT2AL3MBTL1PTGS2
SCHEMBL5118238 0.87 BDKRB1 (0.37) LMNAMEN1KMT2A
SCHEMBL5119431 0.87 LMNA (0.40) LMNA
SCHEMBL5111226 0.85 KMT2A (0.32) LMNAALDH1A1MEN1KMT2A
SCHEMBL5125649 0.84 BDKRB1 (0.38) ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL5118027 0.84 BDKRB1 (0.35)
SCHEMBL5114497 0.83
SCHEMBL5114574 0.83
SCHEMBL5119367 0.82

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