SCHEMBL8417532

SCHEMBL8417532

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.40
EEF2K O00418 2/20 0.39
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 4/20 0.38
CA12 O43570 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
GFER P55789 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
IDO1 P14902 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
EGFR P00533 1/20 0.37
ERBB2 P04626 1/20 0.37
POLB P06746 2/20 0.36
CYP1A2 P05177 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
SCHEMBL8419633 0.98 SIGMAR1 (0.39) SIGMAR1EEF2KFFAR1FFAR4RAB9A
SCHEMBL8419845 0.97 SIGMAR1 (0.40) SIGMAR1EEF2KFFAR1FFAR4RAB9A
SCHEMBL8418072 0.94 SIGMAR1 (0.39) SIGMAR1EEF2KFFAR1FFAR4RAB9A
SCHEMBL8417445 0.93 SIGMAR1 (0.40) SIGMAR1EEF2KFFAR1FFAR4RAB9A
SCHEMBL8419595 0.93 FFAR1 (0.39) SIGMAR1EEF2KFFAR1FFAR4RAB9A
SCHEMBL8417431 0.92 EEF2K (0.37) SIGMAR1EEF2KFFAR1FFAR4RAB9A
SCHEMBL8419454 0.91 UTS2R (0.44) EEF2KALDH1A1NPSR1IDO1CYP1A2
SCHEMBL8417302 0.91 ALDH1A1 (0.46) RAB9AALDH1A1POLBMMP2MMP9
SCHEMBL8419365 0.91 SIGMAR1 (0.40) SIGMAR1EEF2KFFAR1FFAR4RAB9A
SCHEMBL8896082 0.91 SIGMAR1 (0.41) SIGMAR1EEF2KFFAR1FFAR4RAB9A

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