SCHEMBL8035876

SCHEMBL8035876

CCN(CCOc1ccccc1)c1ccc(N=Nc2c(Cl)cc(S(=O)(=O)F)c(Cl)c2Br)cc1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
GBA1 P04062 1/20 0.32
GSK3B P49841 2/20 0.32
PPARA Q07869 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SCN9A Q15858 1/20 0.32
CHRNA7 P36544 1/20 0.31
CHRNA10 Q9GZZ6 1/20 0.31
CHRNA9 Q9UGM1 1/20 0.31
PDK2 Q15119 1/20 0.31
PGR P06401 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
PPARG P37231 1/20 0.30
BDKRB1 P46663 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
SCHEMBL8091987 1.00 L3MBTL1 (0.33) L3MBTL1TDP1GBA1GSK3BPPARA
SCHEMBL8045149 0.86 KMT2A (0.39) L3MBTL1TDP1GSK3BKDM4EALDH1A1
SCHEMBL8045147 0.86 KMT2A (0.39) L3MBTL1TDP1GSK3BKDM4EALDH1A1
SCHEMBL8046207 0.85 MAPT (0.32) L3MBTL1TDP1GSK3BKDM4EALDH1A1
SCHEMBL8046210 0.85 MAPT (0.32) L3MBTL1TDP1GSK3BKDM4EALDH1A1
SCHEMBL8050513 0.81 KMT2A (0.34) L3MBTL1TDP1GSK3BKDM4EALDH1A1
SCHEMBL8053537 0.80 CA12 (0.34) L3MBTL1GSK3BKDM4EALDH1A1SMN1; SMN2
SCHEMBL8053532 0.80 CA12 (0.34) L3MBTL1GSK3BKDM4EALDH1A1SMN1; SMN2
SCHEMBL7769786 0.75 MAPT (0.40) L3MBTL1TDP1GSK3BPPARAKDM4E
SCHEMBL14944896 0.72 MAPT (0.39) L3MBTL1TDP1GSK3BKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6048370-A Monoazo dyes containing a fluorosulphonyl group and use thereof BASF AKTIENGESELLSCHAFT (DE) 2000-04-11 US claimed
EP-0888405-B1 MONOAZO DYES CONTAINING A FLUOROSULPHONYL GROUP AND USE THEROF BASF AG (DE) 2000-04-26 EP disclosed
US-6048370-A Monoazo dyes containing a fluorosulphonyl group and use thereof BASF AKTIENGESELLSCHAFT (DE) 2000-04-11 US disclosed
EP-0888405-A1 MONOAZO DYES CONTAINING A FLUOROSULPHONYL GROUP AND USE THEROF BASF AKTIENGESELLSCHAFT (DE) 1999-01-07 EP disclosed
WO-1997029155-A1 MONOAZO DYES CONTAINING A FLUOROSULPHONYL GROUP AND USE THEROF BASF AKTIENGESELLSCHAFT (DE) 1997-08-14 WO disclosed