SCHEMBL7596576

SCHEMBL7596576

CC(C)(C)NS(=O)(=O)c1cc(CBr)ccc1S(C)(=O)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.38
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 8/20 0.37
NSD2 O96028 2/20 0.36
PARG Q86W56 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
TSHR P16473 1/20 0.33
CNR1 P21554 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
POLB P06746 1/20 0.32
BRD4 O60885 1/20 0.32
BRD2 P25440 1/20 0.32
BRD3 Q15059 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
SCHEMBL7600872 0.83 SMN1; SMN2 (0.37) LMNAMAPTSMN1; SMN2KDM4EMEN1
SCHEMBL22409170 0.83 EDNRB (0.41) LMNAMAPTSMN1; SMN2KDM4EMEN1
SCHEMBL29405486 0.83 EDNRB (0.41) LMNAMAPTSMN1; SMN2KDM4EMEN1
SCHEMBL7598754 0.82 LMNA (0.35) LMNAMAPTSMN1; SMN2KDM4EMEN1
SCHEMBL1795036 0.81 USP30 (0.39) LMNAMAPTSMN1; SMN2KDM4EMEN1
SCHEMBL9826275 0.79 SMN1; SMN2 (0.47) MAPTSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL7600544 0.77 ALDH1A1 (0.46) LMNAMAPTSMN1; SMN2KDM4EMEN1
SCHEMBL9378387 0.77 PARG (0.43) PARG
SCHEMBL7735941 0.76 CA1 (0.39) LMNAMAPTSMN1; SMN2KDM4EMEN1
SCHEMBL21962936 0.76 ALDH1A1 (0.41) LMNAMAPTSMN1; SMN2KDM4EMEN1

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
EP-0900023-B1 SUBSTITUTED AMINOMETHYL PHENYL SULPHONYL UREAS, THEIR PRODUCTION AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE GMBH (DE) 2002-11-27 EP disclosed
US-5925596-A PRE-EMERGENCE AND POST-EMERGENCE HERBICIDES HOECHST-SCHERING AGREVO GMBH (DE) 1999-07-20 US disclosed
EP-0900023-A1 SUBSTITUTED AMINOMETHYL PHENYL SULPHONYL UREAS, THEIR PRODUCTION AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS Hoechst Schering AgrEvo GmbH (DE) 1999-03-10 EP disclosed
WO-1997040690-A1 SUBSTITUTED AMINOMETHYL PHENYL SULPHONYL UREAS, THEIR PRODUCTION AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS HOECHST SCHERING AGREVO GMBH (DE) 1997-11-06 WO disclosed