SCHEMBL8145694

SCHEMBL8145694

N/C(=N\[N+](=O)[O-])NCC1CCOC1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 8/20 0.33
TDP1 Q9NUW8 1/20 0.33
GSK3B P49841 3/20 0.30
KCNH2 Q12809 3/20 0.30

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
SCHEMBL18393466 1.00 NAMPT (0.33) NAMPTTDP1GSK3BKCNH2
SCHEMBL8145696 1.00 NAMPT (0.33) NAMPTTDP1GSK3BKCNH2
SCHEMBL2194777 0.85 NAMPT (0.34) NAMPTGSK3BKCNH2
SCHEMBL14768401 0.82 NAMPT (0.33) NAMPTGSK3BKCNH2
Dinotefuran SCHEMBL7762050 0.80 NAMPT (0.34) NAMPTGSK3BKCNH2
Dinotefuran SCHEMBL182310 0.80 NAMPT (0.34) NAMPTGSK3BKCNH2
SCHEMBL8016496 0.80 NAMPT (0.32) NAMPTGSK3BKCNH2
Dinotefuran SCHEMBL28442208 0.80 NAMPT (0.34) NAMPTGSK3BKCNH2
Dinotefuran SCHEMBL26337 0.80 NAMPT (0.34) NAMPTGSK3BKCNH2
SCHEMBL8016500 0.80 NAMPT (0.32) NAMPTGSK3BKCNH2

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-6103758-A APPLYING TO A TICK, A HOST ANIMAL OF TICKS IN NEED OF TREATMENT AN EFFECTIVE AMOUNT OF A 1-(TETRA HYDROFURAN)METHYL-2-NITROGUANIDINE MITICIDE SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2000-08-15 US claimed