SCHEMBL14920864

SCHEMBL14920864

O=C(O)C1COCCC1c1ccc(F)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.40
HSD11B1 P28845 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HRH3 Q9Y5N1 2/20 0.37
KDM1A O60341 2/20 0.37
PTGS2 P35354 1/20 0.37
SLC6A3 Q01959 2/20 0.36
SIGMAR1 Q99720 1/20 0.36
SLC6A4 P31645 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
FPR2 P25090 1/20 0.36
FFAR1 O14842 1/20 0.36
EPHX1 P07099 1/20 0.36
PRCP P42785 1/20 0.35
KCNH2 Q12809 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
SCHEMBL2188191 0.84 SLC6A4 (0.41) SLC6A3SLC6A4FPR2FFAR1
SCHEMBL2188196 0.84 SLC6A4 (0.41) SLC6A3SLC6A4FPR2FFAR1
SCHEMBL2188200 0.84 SLC6A4 (0.41) SLC6A3SLC6A4FPR2FFAR1
SCHEMBL3184339 0.83 SLC6A2 (0.48) KDM1ASLC6A4FFAR1EPHX1
SCHEMBL3184345 0.83 SLC6A2 (0.48) KDM1ASLC6A4FFAR1EPHX1
SCHEMBL3184354 0.83 SLC6A2 (0.48) KDM1ASLC6A4FFAR1EPHX1
SCHEMBL16141290 0.82 SLC6A3 (0.50) SLC6A3SLC6A4
SCHEMBL16141289 0.82 SLC6A3 (0.50) SLC6A3SLC6A4
SCHEMBL14934470 0.82 SLC6A3 (0.50) SLC6A3SLC6A4
SCHEMBL16108268 0.82 SLC6A3 (0.50) SLC6A3SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2773637-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS Xenon Pharmaceuticals Inc. (CA) 2014-09-10 EP disclosed
WO-2013064983-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2013-05-10 WO disclosed