SCHEMBL8419633

SCHEMBL8419633

COC(=O)CCCc1ccc(C(CCCCC(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
SIGMAR1 Q99720 1/20 0.39
EEF2K O00418 2/20 0.38
RAB9A P51151 1/20 0.38
FFAR1 O14842 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
GFER P55789 1/20 0.37
ALDH1A1 P00352 4/20 0.37
CA2 P00918 2/20 0.37
CA12 O43570 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
IDO1 P14902 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36
POLB P06746 2/20 0.35
CYP1A2 P05177 1/20 0.35

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 0.98 SIGMAR1 (0.40) SIGMAR1EEF2KRAB9AFFAR1FFAR4
SCHEMBL8419845 0.95 SIGMAR1 (0.40) SIGMAR1EEF2KRAB9AFFAR1FFAR4
SCHEMBL8419365 0.94 SIGMAR1 (0.40) SIGMAR1EEF2KRAB9AFFAR1FFAR4
SCHEMBL8417445 0.94 SIGMAR1 (0.40) SIGMAR1EEF2KRAB9AFFAR1FFAR4
SCHEMBL8421534 0.93 SIGMAR1 (0.39) SIGMAR1EEF2KRAB9AFFAR1FFAR4
SCHEMBL8418072 0.93 SIGMAR1 (0.39) SIGMAR1EEF2KRAB9AFFAR1FFAR4
SCHEMBL8421571 0.92 UTS2R (0.42) EEF2KALDH1A1NPSR1CYP1A2CYP2C19
SCHEMBL8896036 0.92 SIGMAR1 (0.40) SIGMAR1EEF2KRAB9AFFAR1FFAR4
SCHEMBL8419595 0.91 FFAR1 (0.39) SIGMAR1EEF2KRAB9AFFAR1FFAR4
SCHEMBL8418158 0.91 LMNA (0.43) SIGMAR1EEF2KFFAR1FFAR4ALDH1A1

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