SCHEMBL7976373

SCHEMBL7976373

FC(F)(F)c1ccc(CNCCCCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)nc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 2/20 0.34
KDM1A O60341 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
CNR1 P21554 2/20 0.32
CNR2 P34972 1/20 0.32
PDE2A O00408 1/20 0.32
S1PR2 O95136 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
LPAR2 Q9HBW0 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
BACE1 P56817 1/20 0.31
HDAC3 O15379 3/20 0.31
HDAC4 P56524 3/20 0.31
HDAC1 Q13547 3/20 0.31
HDAC7 Q8WUI4 3/20 0.31

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
SCHEMBL7979291 0.97 SCN8A (0.37) SCN8AKDM1AMAOAMAOBCNR1
SCHEMBL7979631 0.94 SCN8A (0.38) SCN8AKDM1AMAOAMAOBPDE2A
SCHEMBL7976088 0.92 SCN8A (0.35) SCN8AKDM1AMAOAMAOBCNR1
SCHEMBL7979569 0.92 SCN8A (0.34) SCN8AKDM1AMAOAMAOBCNR1
SCHEMBL7977978 0.91 SCN8A (0.40) SCN8AKDM1AMAOAMAOBPDE2A
SCHEMBL7976161 0.91 SCN8A (0.34) SCN8AKDM1AMAOAMAOBCNR1
SCHEMBL7979403 0.90 SCN8A (0.42) SCN8AKDM1AMAOAMAOBPDE2A
SCHEMBL7976368 0.89 SCN8A (0.36) SCN8AKDM1AMAOAMAOBCNR1
SCHEMBL7979536 0.88 KDM4E (0.35) SCN8AKDM1AMAOAMAOBPDE2A
SCHEMBL7982189 0.88 SCN8A (0.37) SCN8AKDM1AMAOAMAOBCNR1

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
US-6214835-B1 CONTROLLING INSECTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-04-10 US disclosed