SCHEMBL8419595

SCHEMBL8419595

CCOC(=O)CCCc1ccc(C(CCCC(F)(F)C(F)(F)F)NS(=O)(=O)c2ccc(F)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
CYP4Z1 Q86W10 2/20 0.38
CYP4F11 Q9HBI6 1/20 0.38
CYP4F12 Q9HCS2 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
ALDH1A1 P00352 2/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
EEF2K O00418 1/20 0.37
RAB9A P51151 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
GFER P55789 1/20 0.36
AKT1 P31749 1/20 0.36
IRS1 P35568 1/20 0.36
GAB1 Q13480 1/20 0.36
NPSR1 Q6W5P4 2/20 0.36
MAPK1 P28482 2/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL8417532 0.93 SIGMAR1 (0.40) FFAR1FFAR4SIGMAR1ALDH1A1ATM
SCHEMBL8419633 0.91 SIGMAR1 (0.39) FFAR1FFAR4SIGMAR1ALDH1A1ATM
SCHEMBL8419845 0.90 SIGMAR1 (0.40) FFAR1FFAR4SIGMAR1ALDH1A1ATM
SCHEMBL8418072 0.87 SIGMAR1 (0.39) FFAR1FFAR4SIGMAR1ALDH1A1ATM
SCHEMBL8417294 0.87 LMNA (0.45) FFAR1FFAR4SIGMAR1ALDH1A1ATM
SCHEMBL8417445 0.86 SIGMAR1 (0.40) FFAR1FFAR4SIGMAR1ALDH1A1ATM
SCHEMBL8418158 0.85 LMNA (0.43) FFAR1FFAR4SIGMAR1ALDH1A1ATM
SCHEMBL8417431 0.85 EEF2K (0.37) FFAR1FFAR4SIGMAR1ALDH1A1ATM
SCHEMBL8419365 0.84 SIGMAR1 (0.40) FFAR1FFAR4SIGMAR1ALDH1A1ATM
SCHEMBL8417302 0.84 ALDH1A1 (0.46) ALDH1A1RAB9AMEN1KMT2A

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
EP-0943606-A1 BENZENESULFONAMIDE DERIVATIVES AND DRUGS CONTAINING THE SAME HOKURIKU SEIYAKU CO., LTD. (JP) 1999-09-22 EP disclosed