SCHEMBL28366017

SCHEMBL28366017

CS(=O)(=O)c1ccc(F)c(C(=O)N2CCN(c3ncc(C(F)(F)F)cc3F)CC2)c1

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 20/20 0.75
KCNH2 Q12809 6/20 0.75
SLC6A5 Q9Y345 2/20 0.63

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
SCHEMBL4906522 0.90 SLC6A9 (0.69) SLC6A9KCNH2SLC6A5
SCHEMBL27669155 0.88 SLC6A9 (0.79) SLC6A9KCNH2SLC6A5
SCHEMBL8188350 0.88 SLC6A9 (0.77) SLC6A9KCNH2SLC6A5
SCHEMBL3917627 0.87 SLC6A9 (0.71) SLC6A9KCNH2SLC6A5
SCHEMBL4903243 0.87 SLC6A9 (0.71) SLC6A9KCNH2SLC6A5
SCHEMBL4424343 0.87 SLC6A9 (0.87) SLC6A9KCNH2SLC6A5
SCHEMBL4907272 0.87 SLC6A9 (0.66) SLC6A9KCNH2SLC6A5
SCHEMBL562045 0.86 SLC6A9 (0.77) SLC6A9KCNH2SLC6A5
SCHEMBL4901288 0.86 SLC6A9 (0.65) SLC6A9KCNH2SLC6A5
SCHEMBL4423743 0.86 SLC6A9 (0.71) SLC6A9KCNH2SLC6A5

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
CN-106397312-B Method for preparing GLYT-1 inhibitor 广东东阳光药业有限公司 2020-03-24 CN disclosed