SCHEMBL26066067

SCHEMBL26066067

O=S(=O)(c1ccc(C(F)(F)F)nc1C1CC1)N1CCN(CC2CCOCC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.43
EBP Q15125 4/20 0.40
CA2 P00918 1/20 0.40
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 1/20 0.38
CNR2 P34972 3/20 0.38
TPSAB1 Q15661 1/20 0.38

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
SCHEMBL26066147 0.92 KCNH2 (0.42) KCNH2CA2TPSAB1
SCHEMBL25371219 0.87 PSEN1 (0.37) KCNH2EBPCA2PSEN1PSEN2
SCHEMBL26065889 0.87 EBP (0.44) KCNH2EBPPSEN1PSEN2APH1B
SCHEMBL26066093 0.84 MEN1 (0.41)
SCHEMBL26065533 0.82 EBP (0.41) KCNH2EBPCA2CNR2TPSAB1
SCHEMBL26065762 0.81 EBP (0.39) KCNH2EBPCNR2TPSAB1
SCHEMBL26065920 0.81 EBP (0.39) KCNH2EBPCNR2TPSAB1
SCHEMBL26065919 0.81 EBP (0.39) KCNH2EBPCNR2TPSAB1
SCHEMBL26066246 0.81 PSEN1 (0.51) KCNH2EBPPSEN1PSEN2APH1B
SCHEMBL26065523 0.79 EBP (0.41) KCNH2EBPCNR2TPSAB1

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
WO-2023164063-A1 EMOPAMIL-BINDING PROTEIN INHIBITORS AND USES THEREOF BIOGEN MA INC. (US) 2023-08-31 WO disclosed