SCHEMBL8550685

SCHEMBL8550685

COc1nn(C)c(=O)n1-c1ccccc1Oc1nc(-c2cccc(OC(F)(F)F)c2)ns1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
DYRK1A Q13627 5/20 0.35
MAPK14 Q16539 1/20 0.34
MAPT P10636 1/20 0.34
SLC5A1 P13866 1/20 0.34
SCN9A Q15858 1/20 0.34
FYN P06241 1/20 0.34
CTSD P07339 1/20 0.33
BACE1 P56817 1/20 0.33
BACE2 Q9Y5Z0 1/20 0.33
CHRM5 P08912 1/20 0.33
S1PR1 P21453 1/20 0.33
XDH P47989 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL8596743 0.89 FAAH (0.33) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8590947 0.85 DHPS (0.37) MAPTFAAH
SCHEMBL8595340 0.84 RORB (0.34) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8594918 0.83 DRD2 (0.32) MAPT
SCHEMBL8595988 0.81 EIF4E (0.35) MAPT
SCHEMBL8815698 0.81 LMNA (0.32) MAPT
SCHEMBL8811476 0.78 MAPT (0.38) MAPT
SCHEMBL8524457 0.76 SMN1; SMN2 (0.34) MAPTPDE10A
SCHEMBL8816645 0.76 LMNA (0.32)
SCHEMBL8810747 0.75 MEN1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0836384-A1 ARTHROPODICIDAL AND FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-04-22 EP claimed
WO-1997000612-A1 ARTHROPODICIDAL AND FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-01-09 WO claimed
WO-1998023155-A1 ARTHROPODICIDAL AND FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-06-04 WO disclosed
EP-0836384-A1 ARTHROPODICIDAL AND FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-04-22 EP disclosed
WO-1997000612-A1 ARTHROPODICIDAL AND FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-01-09 WO disclosed