SCHEMBL8915689

SCHEMBL8915689

C=CCCCCn1nn[nH]c1=O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.32
NFE2L2 Q16236 1/20 0.32

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
SCHEMBL8915423 0.87 NFE2L2 (0.31) NFE2L2
SCHEMBL10640026 0.73
SCHEMBL5906372 0.70
SCHEMBL6360026 0.69
SCHEMBL19872816 0.66 MEN1 (0.35) XDH
SCHEMBL18882789 0.66 SORT1 (0.41) NFE2L2
SCHEMBL8603062 0.66 NFE2L2 (0.31) NFE2L2
SCHEMBL13835669 0.65 CYP3A4 (0.48)
SCHEMBL8684823 0.65
SCHEMBL28536898 0.64 CYP3A4 (0.36) XDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5668087-A Herbicidal 1-alkenyltetrazolinones NIHON BAYER AGROCHEM K.K. (JP) 1997-09-16 US disclosed
EP-0733624-A1 Herbicidal 1-alkenyltetrazolinones NIHON BAYER AGROCHEM K.K. (JP) 1996-09-25 EP disclosed